data_1zgw_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 1zgw _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 9' ' ' ASP . 20.4 m . . . . . 0 N--CA 1.465 0.302 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.645 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.741 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.468 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.468 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.2 t30 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.56 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.583 ' CE2' ' HD3' ' A' ' 12' ' ' ARG . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.597 HG21 ' HB3' ' A' ' 61' ' ' ALA . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.697 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.744 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.435 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.558 HG21 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.485 ' HB ' HG23 ' A' ' 34' ' ' THR . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.691 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.741 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.655 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.426 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.5 m-70 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.458 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.534 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.744 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.645 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.553 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.728 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.561 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.597 ' HB3' HG21 ' A' ' 28' ' ' VAL . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.617 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.495 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.495 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.459 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.617 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.478 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.717 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.001 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.001 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 ' HA ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.855 HG23 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.578 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.645 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.558 ' CD2' ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 18.4 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 1.12 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.568 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.568 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 1.12 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.404 ' CD2' ' CD2' ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.66 ' HE2' ' HA ' ' A' ' 116' ' ' LEU . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.66 ' HA ' ' HE2' ' A' ' 111' ' ' MET . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.483 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.476 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.855 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.495 ' C ' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.555 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.861 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.474 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.861 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.645 ' OE1' ' HA ' ' A' ' 91' ' ' CYS . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.426 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.41 ' O ' ' C ' ' A' ' 9' ' ' ASP . 72.1 m . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.502 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.539 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.623 ' O ' HG22 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.667 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.539 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.744 HG11 ' CD2' ' A' ' 29' ' ' PHE . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.67 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.512 ' CA ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.625 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.744 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.764 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.417 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.447 HG21 ' HB ' ' A' ' 36' ' ' ILE . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.7 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.607 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.731 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.471 ' CZ ' ' NH2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.711 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.711 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.523 ' HE1' HG13 ' A' ' 16' ' ' VAL . 5.3 m-70 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.478 ' HB2' HG12 ' A' ' 31' ' ' VAL . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.539 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.744 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.599 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.595 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.44 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.625 ' HB1' HG22 ' A' ' 28' ' ' VAL . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.608 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.453 ' C ' ' H ' ' A' ' 71' ' ' ARG . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' NH2' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.677 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.728 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.954 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.954 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.523 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.405 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD22 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.718 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.863 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.863 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.512 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.465 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.516 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.512 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.458 ' CD2' ' CD1' ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.434 ' CD2' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.538 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.538 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.715 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.533 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.715 ' HB2' ' SD ' ' A' ' 111' ' ' MET . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.509 HD13 ' CD2' ' A' ' 117' ' ' HIS . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.591 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CE2' HG23 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.727 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.581 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.581 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.707 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.727 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.591 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.722 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.716 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.716 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.424 ' O ' ' C ' ' A' ' 9' ' ' ASP . 94.0 m . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.562 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.7 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.64 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.593 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.712 HG13 ' CD2' ' A' ' 29' ' ' PHE . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.558 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.717 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.1 t30 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.446 ' HB2' ' HG3' ' A' ' 40' ' ' PRO . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.692 ' OD1' ' CD ' ' A' ' 39' ' ' ARG . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.569 ' CA ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.659 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.525 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.733 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.418 HG21 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.668 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.668 ' HB ' HG23 ' A' ' 34' ' ' THR . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.709 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 . . . . . 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.692 ' CD ' ' OD1' ' A' ' 24' ' ' ASP 0.261 6.0 mtt180 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.666 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.717 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.405 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.3 m-70 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.45 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.542 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.64 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.725 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.497 ' C ' ' H ' ' A' ' 71' ' ' ARG . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.497 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.611 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.741 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.999 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.999 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.824 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.409 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.426 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 90' ' ' ALA 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.46 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.557 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.557 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.464 ' CG1' ' CD2' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.46 ' HB3' ' HG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.685 ' CE ' ' O ' ' A' ' 112' ' ' SER . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.545 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.668 ' HB3' ' CE ' ' A' ' 111' ' ' MET . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.502 ' CB ' HD13 ' A' ' 102' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.553 ' ND1' ' HD2' ' A' ' 129' ' ' LYS . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.5 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.405 HD22 ' OG1' ' A' ' 123' ' ' THR . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CE2' HG23 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.766 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.529 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.824 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.53 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.828 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.766 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.553 ' HD2' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.828 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 91' ' ' CYS . 0.7 OUTLIER -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.78 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.46 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.727 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.473 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.553 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.727 ' HD2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.614 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.749 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.746 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.3 t30 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.596 ' HA3' ' H ' ' A' ' 78' ' ' ASN . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.685 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.56 HG23 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.723 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.445 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.746 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.421 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.501 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.458 HG21 HD11 ' A' ' 36' ' ' ILE . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.661 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 . . . . . 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.749 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.595 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.595 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.423 ' HE1' ' CG1' ' A' ' 16' ' ' VAL . 4.3 m-70 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.461 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.746 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.614 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.723 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.572 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.483 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.407 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.572 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.436 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.573 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.447 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.447 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.432 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.707 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.021 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.021 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.63 ' HA ' HG13 ' A' ' 87' ' ' ILE . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.765 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.945 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.466 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.945 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.697 ' CG ' ' OG1' ' A' ' 101' ' ' THR . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.773 HD11 HG12 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.539 ' HG2' HD11 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.519 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.773 HG12 HD11 ' A' ' 94' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.697 ' OG1' ' CG ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 117' ' ' HIS . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HB3' HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.553 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.553 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.524 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.449 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.449 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.631 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 105' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.564 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.564 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.581 ' CD1' HG21 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.569 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.465 ' CG2' ' O ' ' A' ' 120' ' ' PHE . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.614 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.614 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.698 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.666 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.631 ' HE2' ' CD1' ' A' ' 114' ' ' PHE . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.708 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.606 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.606 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.536 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.8 m . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.542 ' O ' HG22 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.623 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.736 HG12 ' CD2' ' A' ' 29' ' ' PHE . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 22' ' ' ASN . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.304 1.3 t30 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.625 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.561 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.736 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.531 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.767 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.408 ' CG2' HG13 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.518 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' A' ' 34' ' ' THR . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.691 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 . . . . . 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.629 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.469 ' HD2' ' HG2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.628 ' HB3' HG12 ' A' ' 31' ' ' VAL . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.541 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.767 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.623 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.693 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.613 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.699 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.447 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.613 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.405 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.708 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.469 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.507 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.469 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.497 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.708 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.736 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.976 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.976 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.543 HD23 ' C ' ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.787 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.885 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.787 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.885 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.489 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.488 ' HA ' ' OE1' ' A' ' 95' ' ' GLU . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.613 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.613 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.432 ' O ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.445 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.562 ' C ' ' CD1' ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.417 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.548 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.548 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.71 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.454 ' O ' ' HD2' ' A' ' 117' ' ' HIS . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.429 ' CE1' ' HE2' ' A' ' 129' ' ' LYS . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.71 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.57 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.782 ' CE1' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.697 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.543 ' C ' HD23 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.549 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.861 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.697 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.467 ' NZ ' ' CD2' ' A' ' 117' ' ' HIS . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.861 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.581 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.468 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.465 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.415 ' O ' ' C ' ' A' ' 9' ' ' ASP . 21.0 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.504 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.477 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.564 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.579 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.899 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.616 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 78' ' ' ASN 0.316 1.2 t30 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.448 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.586 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.564 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.717 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.655 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.414 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.48 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.717 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 . . . . . 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.899 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.616 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.415 ' HA ' ' SG ' ' A' ' 72' ' ' CYS . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.451 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.707 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.707 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.466 ' HE1' HG11 ' A' ' 16' ' ' VAL . 3.8 m-70 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.462 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 52' ' ' VAL . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.559 ' HG3' ' CD1' ' A' ' 13' ' ' TRP 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.655 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.587 HG21 HG23 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.709 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.533 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.565 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 28' ' ' VAL . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HG3' ' CD2' ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.486 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' CD ' ' A' ' 74' ' ' PRO . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.627 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.54 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.507 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.507 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.632 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 83' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.672 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.951 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m120 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.951 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.415 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.778 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.794 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.794 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.511 ' N ' HD11 ' A' ' 93' ' ' LEU 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.628 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.628 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.515 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.567 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.488 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.413 ' CD2' HD22 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.571 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.462 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.419 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.636 ' CE1' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.658 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.778 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.658 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.409 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.412 ' NE2' ' CD1' ' A' ' 94' ' ' LEU . 3.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.496 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.456 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 11' ' ' GLN . 21.5 m . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.516 ' HA ' ' CD ' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.608 ' O ' HG21 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.639 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.717 HG12 ' CD2' ' A' ' 29' ' ' PHE . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.527 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 1.2 t30 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.431 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.609 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.605 HG21 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.746 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.854 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.413 HG23 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.479 HG21 ' HB ' ' A' ' 36' ' ' ILE . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.479 ' HB ' HG21 ' A' ' 34' ' ' THR . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.701 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 . . . . . 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.652 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.763 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.555 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.555 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.42 ' HE1' ' CG1' ' A' ' 16' ' ' VAL . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.575 ' HB2' HG11 ' A' ' 31' ' ' VAL . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.508 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.854 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.639 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.746 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.595 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.514 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' HG21 ' A' ' 28' ' ' VAL . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.665 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.506 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.45 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.722 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.69 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.98 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.98 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.728 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.84 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.728 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.84 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.406 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.624 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.661 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.661 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.452 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.424 HD13 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.537 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.453 ' HE3' ' CD2' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.468 ' O ' ' ND1' ' A' ' 117' ' ' HIS . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.535 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.51 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 4.2 t60 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.451 ' C ' ' CD1' ' A' ' 116' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.612 ' HB3' ' CA ' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.647 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.418 HD21 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.549 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.884 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.457 ' C ' HD22 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.552 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.867 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.884 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.612 ' CA ' ' HB3' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.867 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.47 ' OE1' ' CE1' ' A' ' 117' ' ' HIS . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.441 ' O ' ' OE1' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.624 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.449 ' O ' ' N ' ' A' ' 10' ' ' ASP . 20.6 m . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.556 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.643 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.652 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.643 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.709 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.1 t30 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.775 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.542 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.757 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.799 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.4 HG21 HG13 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.497 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.467 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.665 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 . . . . . 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.775 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 . . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.709 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.714 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.645 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.645 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.464 ' HE1' ' CG1' ' A' ' 16' ' ' VAL . 6.0 m-70 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.431 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.522 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.799 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.652 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.757 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.596 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.497 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.681 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.596 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.469 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HB3' HD22 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.719 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.719 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.463 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.63 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.735 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.987 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.3 m120 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.987 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.735 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.404 ' HE3' ' CD1' ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.731 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.612 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.731 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.66 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.442 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.665 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.665 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.411 ' CG1' ' CD2' ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 113' ' ' PRO . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.508 ' HG ' HD22 ' A' ' 116' ' ' LEU . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.478 ' CB ' HD11 ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.446 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.547 ' HA ' HD12 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.564 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.473 ' HA ' ' CG ' ' A' ' 118' ' ' ARG . 3.5 t60 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.508 HD22 ' HG ' ' A' ' 105' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.489 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.457 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CD1' HG22 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.611 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.638 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.682 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.611 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.41 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . 0.47 ' CB ' HG21 ' A' ' 127' ' ' THR . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.682 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.66 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.478 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.429 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.494 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.644 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.712 HG11 ' CD2' ' A' ' 29' ' ' PHE . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.552 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.753 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.469 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.469 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.3 t30 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB2' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.735 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.756 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.415 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.586 HG23 ' HB ' ' A' ' 36' ' ' ILE . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.586 ' HB ' HG23 ' A' ' 34' ' ' THR . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.7 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.297 1.3 mtm180 . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.702 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.753 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.499 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.492 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.534 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.644 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.735 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.582 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.738 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.6 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.418 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HG3' ' CD2' ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.521 ' C ' ' H ' ' A' ' 71' ' ' ARG . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.521 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.698 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.997 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.7 m120 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.997 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 124' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.711 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.903 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.903 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.446 ' CD1' ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CG1' ' A' ' 100' ' ' VAL . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.74 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.595 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.631 ' CG1' HD22 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.426 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.434 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.44 ' HB3' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.498 ' HA ' ' CE ' ' A' ' 111' ' ' MET . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.659 ' HB ' ' SD ' ' A' ' 111' ' ' MET . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.577 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.659 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.456 ' O ' ' CE ' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.502 ' HB3' ' CG ' ' A' ' 111' ' ' MET . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.538 ' HB2' ' CE ' ' A' ' 111' ' ' MET . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.573 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.547 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.55 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.843 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.599 ' CG2' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.61 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.826 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.843 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.573 ' HD3' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.826 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 135' ' ' TRP . 3.0 tt0 -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.756 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.74 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 9' ' ' ASP . 63.5 m . . . . . 0 N--CA 1.469 0.482 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.473 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.659 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.621 ' CD1' ' HD3' ' A' ' 49' ' ' ARG . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.777 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.55 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.681 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.464 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.795 ' O ' ' N ' ' A' ' 78' ' ' ASN 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 56' ' ' ALA . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 61' ' ' ALA . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.721 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.407 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.559 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.477 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 . . . . . 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.766 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.777 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.681 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.417 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.471 ' HE1' HG13 ' A' ' 16' ' ' VAL . 6.1 m-70 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.465 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.794 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.566 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.556 ' HB2' HG23 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.542 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.457 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.6 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.406 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.416 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.613 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.792 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.98 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.98 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.792 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.653 HD12 ' HB ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.77 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.77 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.497 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.612 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.612 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.446 HD23 ' CG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.565 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.565 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.632 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.485 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.522 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.632 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.448 ' HA ' ' SD ' ' A' ' 111' ' ' MET . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.524 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.452 HD21 ' OG1' ' A' ' 123' ' ' THR . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.698 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.729 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.464 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.653 ' HB ' HD12 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.814 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.729 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.524 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.814 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.406 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.532 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.434 ' O ' ' C ' ' A' ' 9' ' ' ASP . 21.1 m . . . . . 0 N--CA 1.464 0.237 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 8' ' ' THR . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.508 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.556 ' O ' HG21 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.609 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.508 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.747 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.564 HD13 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.694 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.4 t30 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.541 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.569 HG22 ' HB2' ' A' ' 61' ' ' ALA . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.745 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.741 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.446 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.45 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.409 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.481 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.661 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.2 p90 . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.694 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.506 ' HE1' HG13 ' A' ' 16' ' ' VAL . 4.4 m-70 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.459 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.539 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.741 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.609 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.555 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.484 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.551 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.593 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB2' ' CE2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.497 ' HD3' ' CD2' ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.513 ' C ' ' H ' ' A' ' 71' ' ' ARG . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.709 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.993 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.993 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 25.3 m170 -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.553 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.733 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.957 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.733 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.957 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.658 HD21 ' HG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.545 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.635 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.635 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.545 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.658 ' HG1' HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.421 HD21 ' CB ' ' A' ' 113' ' ' PRO . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.566 ' HB ' ' HG2' ' A' ' 111' ' ' MET . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.562 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.566 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.424 ' CE1' ' NZ ' ' A' ' 129' ' ' LYS . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 4.2 t60 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.432 ' C ' ' CD1' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.536 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.433 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.657 ' CE2' HG21 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.873 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.553 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.574 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.745 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.873 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.492 ' HE2' ' CE1' ' A' ' 117' ' ' HIS . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.745 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 135' ' ' TRP . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.769 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.471 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.495 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.653 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.754 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.775 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.621 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.562 HG21 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.717 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.514 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.43 HG21 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.597 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.8 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.754 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.775 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.49 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.422 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.7 m-70 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.45 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.783 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.653 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.711 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.7 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.544 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB1' HG21 ' A' ' 28' ' ' VAL . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.499 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.499 ' CE2' ' HB1' ' A' ' 64' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.641 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.524 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.592 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.641 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.548 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.694 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.015 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.015 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.653 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.729 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.465 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.661 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.435 ' HB3' ' HG1' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.489 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.512 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.512 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.491 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.435 ' HG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.481 ' HB3' HD23 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.463 ' CE ' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.481 HD23 ' HB3' ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.53 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 77.2 m-70 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.45 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CE1' ' HB ' ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.923 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.569 ' CG2' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.648 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.644 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.814 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.923 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.814 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.433 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.661 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.489 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ASP . 28.2 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.549 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.528 ' O ' HG21 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.678 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.549 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.999 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.583 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.616 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.668 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.496 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 1.2 t30 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 40' ' ' PRO . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.586 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.523 ' CA ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.798 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.605 HG22 ' HB3' ' A' ' 61' ' ' ALA . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.744 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.799 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.437 HG21 HG13 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.526 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.419 HG23 ' N ' ' A' ' 37' ' ' PHE . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 1.8 p90 . . . . . 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.647 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.999 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.668 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.438 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.708 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.618 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.618 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.472 ' HE1' HG11 ' A' ' 16' ' ' VAL . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.509 ' HB2' HG12 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.518 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.799 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.1 m-20 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.678 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.744 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.585 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.522 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.713 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.534 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.571 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.472 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.45 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.45 ' CG ' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.693 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.936 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.8 m120 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.936 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.762 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.527 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.592 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.508 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.636 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.636 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.43 HG12 ' HG ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.538 HD13 ' HA ' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.569 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.446 ' HE1' HG22 ' A' ' 109' ' ' VAL . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.419 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.538 ' HA ' HD13 ' A' ' 102' ' ' LEU . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 3.0 t60 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.537 ' CB ' HD13 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.471 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.606 ' CE2' HG21 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.931 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.507 HG21 HD22 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.933 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.509 ' O ' ' OG1' ' A' ' 127' ' ' THR . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.862 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.931 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.421 ' HD2' ' HD1' ' A' ' 117' ' ' HIS . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.862 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.592 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.426 ' HD3' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.4 HG23 ' CB ' ' A' ' 11' ' ' GLN . 21.1 m . . . . . 0 N--CA 1.465 0.305 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.483 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.499 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.689 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.74 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.753 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.753 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.439 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.439 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HB1' ' NH2' ' A' ' 12' ' ' ARG . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.705 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.499 HD13 HG21 ' A' ' 36' ' ' ILE . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 . . . . . 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.74 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.671 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.434 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.446 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.532 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.689 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.555 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.555 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.572 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.446 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.507 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.507 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.624 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.524 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.512 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.769 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.0 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.0 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.45 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.442 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.512 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.802 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.738 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.912 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.912 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.561 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.48 ' CG1' HD22 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.664 HD11 ' HA ' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.434 ' CD2' HD23 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.563 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.563 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.401 ' HE1' HD21 ' A' ' 116' ' ' LEU . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.44 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.664 ' HA ' HD11 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.598 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.574 ' CB ' HD11 ' A' ' 102' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.486 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.598 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.659 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.854 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.53 HG21 HD23 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.802 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.599 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.599 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.857 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.854 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.486 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.857 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.858 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.858 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.49 ' HA ' ' HG3' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.511 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.646 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.511 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 3.9 tt0 -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.753 HG13 ' CD2' ' A' ' 29' ' ' PHE . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.491 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.3 t30 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.402 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.762 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.591 ' N ' ' HB3' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.483 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.753 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.734 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.422 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.425 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.47 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.619 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.4 p90 . . . . . 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 . . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.656 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.762 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.615 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.527 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.9 m-70 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.505 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.456 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.734 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.646 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.709 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.614 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.503 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.723 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.564 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.562 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.553 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.562 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.409 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.743 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.977 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.977 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.708 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.826 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.785 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.658 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.785 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.475 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 101' ' ' THR . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.571 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.538 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.571 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.576 ' O ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.484 ' HB3' ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.694 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.694 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.433 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.455 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.484 ' HG ' ' HB3' ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.489 ' CG ' ' HB2' ' A' ' 129' ' ' LYS . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.782 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.801 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.554 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.783 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.801 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.489 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.783 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.477 ' HG3' ' HA ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 135' ' ' TRP 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.514 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.43 ' O ' ' C ' ' A' ' 9' ' ' ASP . 20.3 m . . . . . 0 CA--C 1.519 -0.241 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.479 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.685 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.586 ' NE1' HD13 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.479 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.77 HG12 ' CD2' ' A' ' 29' ' ' PHE . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.586 HD13 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.461 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.461 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 1.2 t30 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.606 HG23 ' HB3' ' A' ' 61' ' ' ALA . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.77 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.746 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.441 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.458 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.462 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.704 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.691 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.547 ' HE1' HG11 ' A' ' 16' ' ' VAL . 4.1 m-70 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.456 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.541 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.746 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.581 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.703 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.634 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.516 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.737 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.556 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.418 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.737 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB1' ' CD1' ' A' ' 66' ' ' PHE . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.783 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.981 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.981 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.708 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.41 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.559 HD22 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.789 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.62 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.789 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.62 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.672 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.522 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.672 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.498 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' HD21 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.445 ' CA ' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.568 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.568 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.555 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.652 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.414 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.555 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.588 ' HG ' ' N ' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.588 ' N ' ' HG ' ' A' ' 116' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.473 ' HG3' ' HA ' ' A' ' 115' ' ' HIS . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.453 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.674 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.659 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.559 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.547 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.839 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.659 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.518 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.839 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.462 ' NE2' ' CE1' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 92' ' ' ARG . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 62.8 m . . . . . 0 CA--C 1.519 -0.221 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.492 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.488 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.488 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.724 HG13 ' CD2' ' A' ' 29' ' ' PHE . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.556 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.568 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.66 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 1.2 t30 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.578 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.728 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.786 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.419 HG21 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.539 HG22 ' HB ' ' A' ' 36' ' ' ILE . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.539 ' HB ' HG22 ' A' ' 34' ' ' THR . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.728 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.707 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.66 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' HD3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.457 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.516 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.1 m-20 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.681 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.559 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.568 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.515 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.584 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.438 ' HB1' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.438 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.599 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.547 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.771 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.968 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.968 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.771 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.449 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.528 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.794 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.671 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.794 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.671 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.491 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.527 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.419 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.491 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.579 ' O ' HD11 ' A' ' 105' ' ' LEU . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.713 HD12 ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.584 ' N ' HD11 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.564 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.564 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.474 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.493 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.421 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.713 ' HG ' HD12 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.483 ' CD2' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.424 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.5 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.767 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.725 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.528 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.476 ' HA ' HD22 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.895 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.725 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.895 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.517 ' OE1' ' HA ' ' A' ' 91' ' ' CYS . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.579 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.455 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.579 ' HD2' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.596 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.79 HG13 ' CD2' ' A' ' 29' ' ' PHE . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.582 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.432 ' C ' HD22 ' A' ' 78' ' ' ASN 0.3 1.2 t30 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.669 ' N ' ' HB3' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.628 HG22 ' HB3' ' A' ' 61' ' ' ALA . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.79 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.539 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.697 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.433 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.446 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.48 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.712 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 . . . . . 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.633 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.482 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.689 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.689 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.577 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.0 m-70 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.465 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.697 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.596 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.674 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.525 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.522 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.549 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.628 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.513 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.427 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.464 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.627 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.564 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.737 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.012 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.012 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.645 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.557 HD13 ' HB ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.77 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.65 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.77 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.65 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.666 HD12 ' OG1' ' A' ' 101' ' ' THR . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.504 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.442 ' O ' ' HG3' ' A' ' 95' ' ' GLU . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.609 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.609 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.424 ' CG1' HD21 ' A' ' 94' ' ' LEU . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 113' ' ' PRO . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.42 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' ' SD ' ' A' ' 111' ' ' MET . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.629 ' HB ' ' SD ' ' A' ' 111' ' ' MET . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.563 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.629 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.465 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.457 ' CD1' ' N ' ' A' ' 114' ' ' PHE . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.566 ' HB3' ' CG ' ' A' ' 111' ' ' MET . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CB ' HD13 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.447 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.487 HD23 ' OG1' ' A' ' 123' ' ' THR . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.748 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.74 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.487 ' OG1' HD23 ' A' ' 119' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.557 ' HB ' HD13 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.818 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.74 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.818 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.426 ' NE2' ' CD2' ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.466 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.454 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.652 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.713 HG12 ' CD2' ' A' ' 29' ' ' PHE . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.742 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 1.2 t30 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.637 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.58 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.613 HG23 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.758 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.558 HG21 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 . . . . . 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.677 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.742 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.401 ' HE1' HG11 ' A' ' 16' ' ' VAL . 5.9 m-70 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.461 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.537 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.758 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.652 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.716 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.73 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.409 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.492 ' CE2' ' HB1' ' A' ' 64' ' ' ALA . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.641 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.461 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.641 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.427 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.736 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.0 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.0 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.719 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.758 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.719 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.758 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.539 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.516 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.527 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.583 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.583 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.516 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.539 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.675 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.423 ' CB ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.556 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.516 ' HG3' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.408 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.459 ' O ' ' CE1' ' A' ' 117' ' ' HIS . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.603 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 102' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CG ' HG21 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.627 ' HB2' ' CD ' ' A' ' 128' ' ' PRO 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.581 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.433 ' CG2' ' O ' ' A' ' 120' ' ' PHE . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.608 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.876 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.627 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 117' ' ' HIS . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.876 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 91' ' ' CYS . 0.9 OUTLIER -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.462 ' HA ' ' HE3' ' A' ' 135' ' ' TRP 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.527 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.439 ' O ' ' N ' ' A' ' 10' ' ' ASP . 19.2 m . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.573 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.521 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.577 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.521 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.71 HG12 ' CD2' ' A' ' 29' ' ' PHE . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.695 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.1 t30 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.549 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.961 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.658 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.633 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.605 HG23 ' HB1' ' A' ' 61' ' ' ALA . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.71 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.814 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.424 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 . . . . . 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.961 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.705 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.695 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.493 ' NH1' ' CB ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.671 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.429 ' CB ' ' CG1' ' A' ' 31' ' ' VAL . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.543 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.577 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.673 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.633 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.7 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.55 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CE1' ' A' ' 66' ' ' PHE . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.492 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.716 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.663 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.739 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 1.01 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 1.01 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.579 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.56 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.486 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.467 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.557 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.557 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' MET . . . . . 0.412 ' SD ' ' CG1' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.432 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 118' ' ' ARG . 3.5 t60 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 115' ' ' HIS . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.401 ' HG ' HG12 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.564 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.915 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' THR . . . . . 0.554 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.678 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.776 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' PRO . . . . . 0.915 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.474 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.776 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.483 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 3.6 tm0? -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' TRP . . . . . 0.74 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.579 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.194 0.521 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 51.58 91.84 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.29 -0.882 . . . . 0.0 110.384 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -132.16 121.1 23.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 110.707 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -67.82 -154.56 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.468 -0.77 . . . . 0.0 108.931 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.563 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.7 m -65.7 44.24 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.263 -0.898 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.46 36.25 0.15 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.445 -0.785 . . . . 0.0 110.259 179.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 179.78 64.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.265 -0.897 . . . . 0.0 111.502 -179.462 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 9' ' ' ASP . 20.4 m -80.64 63.93 5.24 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.645 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.741 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.468 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.468 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.2 t30 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.56 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.583 ' CE2' ' HD3' ' A' ' 12' ' ' ARG . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.597 HG21 ' HB3' ' A' ' 61' ' ' ALA . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.697 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.744 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.435 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.558 HG21 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.515 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -145.9 118.3 8.47 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.511 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.691 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 -87.86 173.71 6.08 Favored Pre-proline 0 C--N 1.287 -2.116 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.741 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.429 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.655 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.837 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.5 m-70 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.566 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.534 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.744 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.645 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.553 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.728 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.561 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.597 ' HB3' HG21 ' A' ' 28' ' ' VAL . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.617 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.647 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.495 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.459 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.617 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.478 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.717 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.001 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.001 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 ' HA ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.855 HG23 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.578 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.645 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.558 ' CD2' ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 18.4 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 1.12 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.568 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.568 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 1.12 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.404 ' CD2' ' CD2' ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.66 ' HE2' ' HA ' ' A' ' 116' ' ' LEU . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.45 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.946 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.66 ' HA ' ' HE2' ' A' ' 111' ' ' MET . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.483 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.413 HH12 ' H42' ' B' ' 203' ' ' ' DC' . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.476 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.855 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.495 ' C ' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.555 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.861 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 1.071 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.545 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.861 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.645 ' OE1' ' HA ' ' A' ' 91' ' ' CYS . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.426 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.33 1 C3'-C2'-C1' 114.792 8.637 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.565 3 C3'-C2'-C1' 113.723 7.873 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.632 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.829 1 C3'-C2'-C1' 114.911 8.722 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.644 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.25 2 C3'-C2'-C1' 114.944 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.644 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.707 2 C3'-C2'-C1' 114.535 8.454 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.713 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.031 2 C3'-C2'-C1' 114.241 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.756 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.107 8.148 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.756 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.114 2 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.553 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.997 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.708 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 1 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.708 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.05 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.946 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.798 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.599 1 C3'-C2'-C1' 114.526 8.447 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.756 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.65 2 C3'-C2'-C1' 114.909 8.721 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.591 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 2 C3'-C2'-C1' 115.749 9.321 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.636 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.652 2 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.636 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.876 2 C3'-C2'-C1' 114.846 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.522 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.706 8.576 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.493 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.145 2 C3'-C2'-C1' 114.347 8.319 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.562 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.19 2 C3'-C2'-C1' 114.626 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.562 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.028 2 C3'-C2'-C1' 114.594 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 1.071 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.291 1 C3'-C2'-C1' 114.876 8.697 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.622 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.086 1 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.667 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.667 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.162 1 C3'-C2'-C1' 115.213 8.938 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.627 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.693 8.566 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.559 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.587 1 C3'-C2'-C1' 114.815 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.559 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.079 1 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.72 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.72 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.224 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.647 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.403 -11.537 1 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.837 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.412 -10.589 2 C3'-C2'-C1' 114.884 8.703 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.574 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.713 2 C3'-C2'-C1' 115.522 9.158 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.517 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.173 2 C3'-C2'-C1' 114.804 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.517 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.726 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.482 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.497 2 C3'-C2'-C1' 114.223 8.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.222 0.534 . . . . 0.0 110.138 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.62 121.89 46.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.0 110.046 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -151.34 99.61 2.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 110.31 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.467 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.37 -154.84 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.163 -0.96 . . . . 0.0 109.274 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 9.0 t -72.5 45.34 0.13 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 110.384 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.548 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.56 68.01 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -179.29 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.95 27.55 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.263 -0.898 . . . . 0.0 111.909 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.41 ' O ' ' C ' ' A' ' 9' ' ' ASP . 72.1 m -80.04 64.41 4.86 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.786 -1.196 . . . . 0.0 107.928 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.502 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.539 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.623 ' O ' HG22 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.667 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.539 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.744 HG11 ' CD2' ' A' ' 29' ' ' PHE . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.67 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.512 ' CA ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.625 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.744 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.764 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.417 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.447 HG21 ' HB ' ' A' ' 36' ' ' ILE . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.585 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.7 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -147.12 116.77 7.1 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.459 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.607 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 -87.46 177.82 2.52 Favored Pre-proline 0 C--N 1.289 -2.039 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.122 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.731 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.543 ' HB2' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.711 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.863 ' HB3' " H4'" ' C' ' 234' ' ' ' DT' . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.939 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 5.3 m-70 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.779 ' HA ' ' OP1' ' C' ' 235' ' ' ' DT' . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.539 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.744 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.599 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.595 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.44 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.625 ' HB1' HG22 ' A' ' 28' ' ' VAL . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.608 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.544 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.533 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.677 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.728 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.954 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.954 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.523 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.405 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD22 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.718 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.863 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.863 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.512 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.465 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.516 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.512 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.458 ' CD2' ' CD1' ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' CD2' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.538 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.538 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.715 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.533 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.557 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.775 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.509 HD13 ' CD2' ' A' ' 117' ' ' HIS . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.591 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CE2' HG23 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.727 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.581 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.581 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.707 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.727 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 1.033 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.555 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.722 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.716 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.716 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.514 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.263 1 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 " O5'" " H2'" ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.401 -11.673 3 C3'-C2'-C1' 113.674 7.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.552 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.983 1 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.573 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.258 2 C3'-C2'-C1' 114.871 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.702 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.945 2 C3'-C2'-C1' 114.924 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.702 " O5'" H2'' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.836 2 C3'-C2'-C1' 114.224 8.232 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.674 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.408 -10.974 1 C3'-C2'-C1' 114.388 8.349 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.67 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.059 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.543 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.668 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.735 1 C3'-C2'-C1' 115.162 8.901 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.668 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.262 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.809 H2'' " O5'" ' B' ' 202' ' ' ' DG' . . . . . . . . 3 C3'--C2' 1.408 -11.003 1 C3'-C2'-C1' 114.584 8.489 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.809 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.887 1 C3'-C2'-C1' 114.678 8.556 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.74 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.571 2 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.614 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.247 2 C3'-C2'-C1' 115.795 9.354 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.614 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.649 2 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.627 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.807 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.627 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.551 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.195 2 C3'-C2'-C1' 114.258 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.551 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.305 2 C3'-C2'-C1' 114.568 8.477 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.557 ' OP2' ' CZ ' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.415 -10.316 2 C3'-C2'-C1' 114.57 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 1.033 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.433 1 C3'-C2'-C1' 115.07 8.835 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.622 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.934 1 C3'-C2'-C1' 114.921 8.729 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.622 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.066 2 C3'-C2'-C1' 114.521 8.443 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.645 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.11 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.645 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.759 2 C3'-C2'-C1' 114.686 8.561 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.643 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.336 1 C3'-C2'-C1' 114.881 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.643 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.175 2 C3'-C2'-C1' 114.61 8.507 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.741 H2'' " C5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.078 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.753 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.144 8.889 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.753 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.079 1 C3'-C2'-C1' 114.9 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.91 H2'' " O5'" ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.465 2 C3'-C2'-C1' 114.321 8.301 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.939 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.696 2 C3'-C2'-C1' 115.534 9.167 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.587 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.419 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.553 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.823 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.52 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.437 2 C3'-C2'-C1' 114.318 8.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.729 0.3 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -121.5 -25.33 5.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.855 -1.153 . . . . 0.0 110.822 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -167.45 133.63 2.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.995 -1.065 . . . . 0.0 110.488 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -82.17 -154.91 0.13 Allowed 'General case' 0 N--CA 1.484 1.229 0 O-C-N 121.203 -0.936 . . . . 0.0 108.78 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.726 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.8 m -73.58 41.25 0.11 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.103 . . . . 0.0 110.087 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.726 ' HB2' ' O ' ' A' ' 5' ' ' THR . 90.2 m 79.36 51.83 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 120.993 0.425 . . . . 0.0 110.216 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.17 0.4 0.61 Allowed 'General case' 0 C--N 1.308 -1.212 0 O-C-N 121.236 -0.915 . . . . 0.0 111.886 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.424 ' O ' ' C ' ' A' ' 9' ' ' ASP . 94.0 m -81.67 67.89 7.81 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 120.872 -1.142 . . . . 0.0 108.101 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.562 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.7 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.64 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.593 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.712 HG13 ' CD2' ' A' ' 29' ' ' PHE . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.558 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.717 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.1 t30 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.446 ' HB2' ' HG3' ' A' ' 40' ' ' PRO . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.692 ' OD1' ' CD ' ' A' ' 39' ' ' ARG . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.569 ' CA ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.659 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.525 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.733 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.418 HG21 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.668 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.668 ' HB ' HG23 ' A' ' 34' ' ' THR . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.709 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 -144.31 117.33 8.86 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.48 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.692 ' CD ' ' OD1' ' A' ' 24' ' ' ASP 0.261 6.0 mtt180 -88.8 176.85 2.91 Favored Pre-proline 0 C--N 1.284 -2.274 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.086 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.666 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.717 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.699 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.808 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.3 m-70 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.584 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.542 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.64 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.725 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.742 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HB3' H5'' ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.497 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.611 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.741 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.999 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.999 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.824 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.409 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.426 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 90' ' ' ALA 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.46 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.557 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.557 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.464 ' CG1' ' CD2' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.46 ' HB3' ' HG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.685 ' CE ' ' O ' ' A' ' 112' ' ' SER . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.545 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.422 ' CZ ' ' H72' ' C' ' 223' ' ' ' DT' . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.916 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.502 ' CB ' HD13 ' A' ' 102' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.553 ' ND1' ' HD2' ' A' ' 129' ' ' LYS . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.5 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.405 HD22 ' OG1' ' A' ' 123' ' ' THR . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CE2' HG23 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.766 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.529 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.824 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.53 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.828 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.766 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.733 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.572 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.828 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 91' ' ' CYS . 0.7 OUTLIER -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.78 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.46 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.531 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.218 1 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.635 2 C3'-C2'-C1' 113.701 7.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.808 1 C3'-C2'-C1' 114.928 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.674 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 2 C3'-C2'-C1' 114.983 8.774 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.674 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.783 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.42 -9.813 2 C3'-C2'-C1' 114.263 8.26 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.783 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.412 -10.645 2 C3'-C2'-C1' 114.168 8.191 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.732 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.699 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.914 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.72 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.408 -11.04 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.72 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.245 2 C3'-C2'-C1' 114.696 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.916 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.774 1 C3'-C2'-C1' 114.845 8.675 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.793 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.622 1 C3'-C2'-C1' 114.548 8.463 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.75 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.83 2 C3'-C2'-C1' 114.953 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.64 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 115.626 9.233 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.64 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.71 2 C3'-C2'-C1' 114.896 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.594 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.93 2 C3'-C2'-C1' 114.899 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.557 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.517 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.074 2 C3'-C2'-C1' 114.357 8.327 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.602 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.184 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.742 H2'' " O5'" ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.545 8.461 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.742 " O5'" H2'' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.996 2 C3'-C2'-C1' 114.941 8.743 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.726 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.953 1 C3'-C2'-C1' 115.134 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.726 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.054 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.644 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.326 1 C3'-C2'-C1' 115.184 8.917 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.644 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.904 2 C3'-C2'-C1' 114.739 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.586 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.547 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.586 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.073 1 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.73 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.214 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.73 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.154 2 C3'-C2'-C1' 115.148 8.891 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.742 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.808 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.408 -11.01 2 C3'-C2'-C1' 114.648 8.534 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.584 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.413 -10.508 2 C3'-C2'-C1' 115.575 9.197 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.538 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.482 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.538 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.733 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.531 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.302 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 mtm . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 132.27 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.105 -0.997 . . . . 0.0 111.165 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.99 -129.98 0.29 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.767 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -107.04 -154.34 0.52 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.521 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 t -63.67 22.84 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.843 -1.161 . . . . 0.0 108.938 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.767 ' H ' ' C ' ' A' ' 4' ' ' ALA . 1.1 t 79.74 -154.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -178.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.717 ' HG ' ' C ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER 68.46 -14.98 0.24 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.099 -1.001 . . . . 0.0 111.395 178.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.727 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m -79.84 63.6 4.44 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.817 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.473 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.553 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.727 ' HD2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.614 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.749 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.746 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.3 t30 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.596 ' HA3' ' H ' ' A' ' 78' ' ' ASN . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.685 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.56 HG23 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.723 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.445 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.746 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.421 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.501 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.505 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.661 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 -148.23 118.12 7.16 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.483 ' SG ' ' CB ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 -84.54 172.43 9.03 Favored Pre-proline 0 C--N 1.279 -2.481 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 177.4 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.749 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.595 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.633 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.811 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.3 m-70 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.618 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.746 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.614 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.723 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.572 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.483 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.407 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.572 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.436 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.573 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.723 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.534 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.447 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.432 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.707 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.021 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.021 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.63 ' HA ' HG13 ' A' ' 87' ' ' ILE . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.765 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.945 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.466 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.945 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.697 ' CG ' ' OG1' ' A' ' 101' ' ' THR . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.773 HD11 HG12 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.539 ' HG2' HD11 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.519 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.773 HG12 HD11 ' A' ' 94' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.697 ' OG1' ' CG ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 117' ' ' HIS . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HB3' HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.553 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.553 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.524 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.449 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.449 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.631 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.848 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 105' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.564 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.564 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.581 ' CD1' HG21 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.569 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.465 ' CG2' ' O ' ' A' ' 120' ' ' PHE . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.614 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.614 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.698 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.666 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.951 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.564 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.708 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.606 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.606 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.536 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.56 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -11.037 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.56 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 3 C3'-C2'-C1' 113.638 7.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.635 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 115.049 8.821 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.667 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.992 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.667 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.64 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.729 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.081 2 C3'-C2'-C1' 114.147 8.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.755 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.412 -10.621 1 C3'-C2'-C1' 114.2 8.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.755 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.996 8.783 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.549 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.769 8.621 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.715 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.715 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.903 2 C3'-C2'-C1' 114.715 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.848 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.447 8.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.762 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.801 1 C3'-C2'-C1' 114.588 8.492 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.744 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.582 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.585 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.086 2 C3'-C2'-C1' 115.712 9.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.602 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.569 2 C3'-C2'-C1' 114.914 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.602 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.82 2 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.548 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.515 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.144 2 C3'-C2'-C1' 114.194 8.21 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.515 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.647 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.951 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.29 1 C3'-C2'-C1' 114.902 8.716 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.559 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.979 1 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.559 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 114.431 8.379 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.597 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.413 -10.463 2 C3'-C2'-C1' 115.141 8.886 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.597 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.786 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.598 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.374 1 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.598 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.75 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.969 2 C3'-C2'-C1' 114.742 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.75 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 115.086 8.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.723 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.359 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.811 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.618 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 115.474 9.124 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.518 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.356 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.518 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.809 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.459 2 C3'-C2'-C1' 114.292 8.28 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.194 0.521 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 53.39 92.9 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.412 -0.805 . . . . 0.0 110.547 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.93 145.43 33.03 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.402 -0.811 . . . . 0.0 110.306 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.595 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -65.78 -154.56 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.253 -0.905 . . . . 0.0 109.083 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.551 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 1.2 t -67.94 34.09 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.262 -0.899 . . . . 0.0 110.616 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.595 ' H ' ' C ' ' A' ' 4' ' ' ALA . 0.9 OUTLIER 79.84 53.06 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -171.61 35.58 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.326 -0.859 . . . . 0.0 111.672 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.8 m -83.57 63.76 7.56 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.542 ' O ' HG22 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.623 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.736 HG12 ' CD2' ' A' ' 29' ' ' PHE . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 22' ' ' ASN . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.304 1.3 t30 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.625 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.561 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.736 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.531 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.767 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.408 ' CG2' HG13 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.518 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' A' ' 34' ' ' THR . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.691 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 -147.09 118.92 8.09 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.558 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 -84.47 168.85 18.9 Favored Pre-proline 0 C--N 1.284 -2.241 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.487 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.629 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.524 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.689 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.2 m-70 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.628 ' HB3' HG12 ' A' ' 31' ' ' VAL . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.541 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.767 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.623 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.693 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.613 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.699 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.447 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.613 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.405 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.708 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.674 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.507 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.469 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.497 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.708 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.736 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.976 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.976 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.543 HD23 ' C ' ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.787 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.885 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.787 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.885 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.489 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.488 ' HA ' ' OE1' ' A' ' 95' ' ' GLU . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.613 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.613 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.432 ' O ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.445 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.562 ' C ' ' CD1' ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.417 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.548 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.548 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.71 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.454 ' O ' ' HD2' ' A' ' 117' ' ' HIS . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.452 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.821 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.57 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.428 ' NH2' ' N7 ' ' C' ' 225' ' ' ' DG' . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.782 ' CE1' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.697 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.543 ' C ' HD23 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.549 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.861 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.697 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.82 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.515 ' CB ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.861 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.581 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.468 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.465 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.555 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.383 1 C3'-C2'-C1' 114.781 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.555 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.751 3 C3'-C2'-C1' 113.632 7.808 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.616 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.79 2 C3'-C2'-C1' 114.935 8.739 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.703 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 115.097 8.855 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.703 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.992 2 C3'-C2'-C1' 114.798 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.672 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.42 -9.764 2 C3'-C2'-C1' 114.182 8.201 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.744 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.153 8.18 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.744 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.545 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.901 2 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.76 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.727 1 C3'-C2'-C1' 115.307 9.005 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.76 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.708 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.821 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.52 1 C3'-C2'-C1' 114.763 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.77 H2'' " O5'" ' B' ' 203' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.893 1 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.77 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.572 2 C3'-C2'-C1' 114.767 8.619 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.553 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.6 9.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.632 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.06 8.828 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.642 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.893 2 C3'-C2'-C1' 114.772 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.642 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.315 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.548 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.183 2 C3'-C2'-C1' 114.308 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.548 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.096 2 C3'-C2'-C1' 114.608 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.736 H2'' " O5'" ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.82 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.419 -9.876 1 C3'-C2'-C1' 114.892 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.6 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.949 1 C3'-C2'-C1' 114.974 8.767 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.766 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.874 2 C3'-C2'-C1' 114.506 8.433 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.766 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.262 1 C3'-C2'-C1' 115.084 8.846 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.574 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.951 2 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.573 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.389 1 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.573 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.7 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.021 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.7 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.218 2 C3'-C2'-C1' 115.202 8.93 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.674 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.405 -11.273 1 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.689 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.622 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 115.546 9.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.516 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.413 2 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.516 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.84 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.499 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.404 2 C3'-C2'-C1' 114.28 8.272 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.055 0.455 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm 52.11 94.28 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.399 -0.813 . . . . 0.0 110.601 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -167.08 70.43 0.1 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.128 -0.982 . . . . 0.0 110.742 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -78.88 -154.7 0.08 Allowed 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.195 -0.941 . . . . 0.0 108.682 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.582 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.3 m -70.62 38.37 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 O-C-N 120.998 -1.064 . . . . 0.0 110.18 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.582 ' HB2' ' O ' ' A' ' 5' ' ' THR . 37.7 m 79.41 61.98 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.736 -0.602 . . . . 0.0 109.547 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.432 ' CD2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -157.9 28.95 0.26 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 121.317 -0.864 . . . . 0.0 111.962 -179.125 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.415 ' O ' ' C ' ' A' ' 9' ' ' ASP . 21.0 m -79.97 64.36 4.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 107.993 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.504 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.477 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.564 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.579 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.899 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.616 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 78' ' ' ASN 0.316 1.2 t30 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.448 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.586 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.564 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.717 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.655 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.414 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.48 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.589 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.717 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 -145.72 114.84 7.02 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.424 ' CS ' ' OP1' ' C' ' 234' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.49 176.73 2.31 Favored Pre-proline 0 C--N 1.284 -2.248 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.899 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.616 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.415 ' HA ' ' SG ' ' A' ' 72' ' ' CYS . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.507 ' CB ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.707 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.804 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.987 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 3.8 m-70 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.709 ' HA ' ' OP1' ' C' ' 235' ' ' ' DT' . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 52' ' ' VAL . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.559 ' HG3' ' CD1' ' A' ' 13' ' ' TRP 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.655 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.587 HG21 HG23 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.709 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.533 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.565 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 28' ' ' VAL . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HG3' ' CD2' ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.486 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.619 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.85 ' HB2' " C5'" ' C' ' 233' ' ' ' DA' . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.54 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.507 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.507 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.632 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 83' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.672 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.951 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m120 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.951 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.415 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.778 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.794 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.794 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.511 ' N ' HD11 ' A' ' 93' ' ' LEU 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.628 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.628 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.515 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.567 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.488 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.53 ' CE1' ' OP2' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.741 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.413 ' CD2' HD22 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.571 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.523 HH12 ' N4 ' ' C' ' 226' ' ' ' DC' . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.419 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.636 ' CE1' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.658 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.778 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.658 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.835 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.683 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.412 ' NE2' ' CD1' ' A' ' 94' ' ' LEU . 3.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.496 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.456 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.502 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.347 1 C3'-C2'-C1' 114.68 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.594 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.712 3 C3'-C2'-C1' 113.74 7.885 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.594 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 115.127 8.877 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.16 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.584 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.731 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.197 2 C3'-C2'-C1' 114.205 8.218 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.731 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.839 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.717 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.96 2 C3'-C2'-C1' 114.933 8.738 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.571 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.605 8.504 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.612 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.592 1 C3'-C2'-C1' 115.039 8.814 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.612 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 1 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.809 H2'' " O5'" ' B' ' 202' ' ' ' DG' . . . . . . . . 3 C3'--C2' 1.412 -10.585 1 C3'-C2'-C1' 114.492 8.423 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.809 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.616 1 C3'-C2'-C1' 114.571 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.674 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.798 2 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.592 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.222 2 C3'-C2'-C1' 115.789 9.35 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.604 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.832 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.787 2 C3'-C2'-C1' 114.714 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.646 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.403 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.414 ' H6 ' " H2'" ' C' ' 221' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.403 -11.456 2 C3'-C2'-C1' 114.273 8.267 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.498 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.54 8.457 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.53 ' OP2' ' CE1' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.419 -9.908 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.942 ' OP2' ' H72' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.426 1 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.592 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.42 -9.763 1 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.672 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.069 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.672 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.874 1 C3'-C2'-C1' 115.285 8.989 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.567 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.762 2 C3'-C2'-C1' 114.745 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.609 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.447 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.609 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.023 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.722 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.951 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.831 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.844 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.85 " C5'" ' HB2' ' A' ' 71' ' ' ARG . . . . . . . . 2 C3'--C2' 1.401 -11.674 2 C3'-C2'-C1' 114.072 8.123 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.898 H2'' " O5'" ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.647 2 C3'-C2'-C1' 114.6 8.5 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.987 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.692 2 C3'-C2'-C1' 115.661 9.258 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.541 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.541 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.503 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.515 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.389 2 C3'-C2'-C1' 114.278 8.27 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.093 0.473 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 1.0 OUTLIER 65.15 -137.43 0.22 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.41 -0.806 . . . . 0.0 110.598 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 70.6 mttt 63.87 149.0 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.05 -1.031 . . . . 0.0 109.829 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -98.66 165.87 11.6 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.134 -0.979 . . . . 0.0 111.614 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.638 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 p -66.12 77.69 0.09 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.506 0.67 . . . . 0.0 109.396 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.638 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.8 t 89.37 -178.27 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.475 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.8 OUTLIER 54.53 24.59 5.46 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.919 -1.113 . . . . 0.0 109.463 -179.363 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 11' ' ' GLN . 21.5 m -99.67 64.33 1.28 Allowed 'General case' 0 C--N 1.296 -1.737 0 C-N-CA 119.739 -0.784 . . . . 0.0 109.403 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.516 ' HA ' ' CD ' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.608 ' O ' HG21 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.639 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.717 HG12 ' CD2' ' A' ' 29' ' ' PHE . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.527 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 1.2 t30 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.431 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.609 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.605 HG21 ' HB1' ' A' ' 61' ' ' ALA . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.746 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.854 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.413 HG23 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.479 HG21 ' HB ' ' A' ' 36' ' ' ILE . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.479 ' HB ' HG21 ' A' ' 34' ' ' THR . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.701 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 -146.73 119.2 8.45 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.489 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 -82.58 164.47 47.11 Favored Pre-proline 0 C--N 1.286 -2.192 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.652 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.763 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.484 ' SG ' ' CS ' ' A' ' 38' ' ' SMC . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.555 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.796 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.638 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.508 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.854 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.639 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.746 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.595 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.514 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' HG21 ' A' ' 28' ' ' VAL . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.665 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.876 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.517 ' HE2' ' OP1' ' C' ' 232' ' ' ' DA' . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.45 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.722 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.69 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.98 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.98 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.728 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.84 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.728 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.84 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.406 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.624 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.661 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.661 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.452 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.424 HD13 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.537 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.453 ' HE3' ' CD2' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.468 ' O ' ' ND1' ' A' ' 117' ' ' HIS . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.535 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.714 ' CE1' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.451 ' C ' ' CD1' ' A' ' 116' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.612 ' HB3' ' CA ' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.653 ' NH2' ' H42' ' C' ' 226' ' ' ' DC' . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.418 HD21 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.549 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.884 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.457 ' C ' HD22 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.552 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.867 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.884 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.755 ' CG ' ' OP2' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.885 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.867 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.47 ' OE1' ' CE1' ' A' ' 117' ' ' HIS . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.405 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.441 ' O ' ' OE1' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.624 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.393 1 C3'-C2'-C1' 114.849 8.678 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.589 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.607 3 C3'-C2'-C1' 113.686 7.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.589 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 115.262 8.973 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.676 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.455 1 C3'-C2'-C1' 115.072 8.837 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.676 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.62 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.113 2 C3'-C2'-C1' 114.191 8.208 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.755 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.965 1 C3'-C2'-C1' 114.17 8.193 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.755 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.914 8.724 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.543 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.017 2 C3'-C2'-C1' 114.749 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.722 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.929 1 C3'-C2'-C1' 115.34 9.029 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.722 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.116 2 C3'-C2'-C1' 114.734 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.778 " O5'" ' H6 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 4 C3'--C2' 1.406 -11.223 1 C3'-C2'-C1' 114.516 8.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.771 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.993 1 C3'-C2'-C1' 114.468 8.406 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.636 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.531 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.602 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.552 2 C3'-C2'-C1' 115.658 9.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.602 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.842 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.55 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.77 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.55 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.325 2 C3'-C2'-C1' 114.806 8.647 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.51 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.403 -11.453 2 C3'-C2'-C1' 114.33 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.689 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.689 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.21 2 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.885 ' OP1' ' HA ' ' A' ' 130' ' ' ALA . . . . . . . . 2 C3'--C2' 1.421 -9.692 2 C3'-C2'-C1' 115.035 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.691 " O5'" H2'' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.953 2 C3'-C2'-C1' 114.927 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.653 ' H42' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.523 8.445 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.68 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.099 1 C3'-C2'-C1' 115.214 8.939 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.68 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.718 2 C3'-C2'-C1' 114.717 8.583 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.589 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.344 1 C3'-C2'-C1' 114.848 8.677 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.589 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.068 1 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.78 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.987 2 C3'-C2'-C1' 114.93 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.78 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.078 8.841 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.876 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.409 -10.939 1 C3'-C2'-C1' 114.703 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.796 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.407 -11.127 2 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.642 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.581 9.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.566 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.304 2 C3'-C2'-C1' 114.805 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.596 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.867 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.596 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.295 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.201 0.525 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -114.52 -22.36 9.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.346 -0.846 . . . . 0.0 110.415 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.28 159.35 1.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.154 -0.966 . . . . 0.0 109.776 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.557 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -122.48 -154.4 0.6 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.088 -1.007 . . . . 0.0 110.594 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.562 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -60.61 25.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.423 -0.798 . . . . 0.0 112.731 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.562 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.6 OUTLIER 79.63 120.8 0.05 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.188 -0.945 . . . . 0.0 110.402 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.533 ' N ' ' CD2' ' A' ' 7' ' ' LEU . 2.8 mm? 59.81 63.82 1.41 Allowed 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 122.981 1.372 . . . . 0.0 110.203 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.518 ' OG1' ' HB2' ' A' ' 4' ' ' ALA . 20.6 m -86.91 66.31 9.37 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 113.847 -1.524 . . . . 0.0 107.99 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.556 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.643 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.652 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.643 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.709 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.1 t30 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.775 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.542 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.757 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.799 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.4 HG21 HG13 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.497 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.541 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.665 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 -143.1 118.17 10.08 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.496 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.775 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER -82.0 164.69 47.29 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.03 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.709 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.714 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.423 ' HB2' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.645 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.657 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.848 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.0 m-70 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.648 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.522 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.799 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.652 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.757 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.596 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.497 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.681 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.553 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.596 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.469 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HB3' HD22 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.757 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.719 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.463 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.63 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.735 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.987 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.3 m120 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.987 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.735 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.404 ' HE3' ' CD1' ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.731 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.612 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.731 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.66 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.442 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.665 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.665 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.411 ' CG1' ' CD2' ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 113' ' ' PRO . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.508 ' HG ' HD22 ' A' ' 116' ' ' LEU . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.478 ' CB ' HD11 ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.558 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.558 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.446 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.547 ' HA ' HD12 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.564 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.884 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.508 HD22 ' HG ' ' A' ' 105' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.489 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.457 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CD1' HG22 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.611 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.638 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.682 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.611 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.932 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.83 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.682 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.66 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.478 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.53 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.366 1 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.559 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.611 2 C3'-C2'-C1' 113.622 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.559 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.649 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.251 1 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.566 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.656 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.173 8.195 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.744 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.973 1 C3'-C2'-C1' 114.171 8.194 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.744 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.103 2 C3'-C2'-C1' 114.917 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.564 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.083 2 C3'-C2'-C1' 114.695 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.692 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.117 8.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.692 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.752 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.884 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.406 -11.206 1 C3'-C2'-C1' 114.542 8.459 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.804 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.668 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.644 2 C3'-C2'-C1' 114.807 8.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.64 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.138 2 C3'-C2'-C1' 115.718 9.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.64 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.592 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.722 8.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.592 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.756 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.526 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.178 2 C3'-C2'-C1' 114.344 8.317 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.526 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.089 2 C3'-C2'-C1' 114.488 8.42 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.524 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.982 ' OP2' ' H72' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.327 1 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.237 1 C3'-C2'-C1' 115.075 8.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.646 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.954 1 C3'-C2'-C1' 114.437 8.384 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.622 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.109 1 C3'-C2'-C1' 115.31 9.007 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.622 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.675 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.58 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.554 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.587 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.863 1 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.72 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.88 2 C3'-C2'-C1' 114.831 8.665 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.74 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.328 2 C3'-C2'-C1' 114.899 8.713 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.757 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.408 -11.046 2 C3'-C2'-C1' 114.559 8.471 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.848 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.698 2 C3'-C2'-C1' 114.683 8.559 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.792 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.609 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.584 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.695 2 C3'-C2'-C1' 114.508 8.434 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.584 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.398 2 C3'-C2'-C1' 114.329 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 tpt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.209 0.528 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 53.66 95.96 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.407 -0.808 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -107.58 155.21 20.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.344 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.14 -162.19 0.07 Allowed 'General case' 0 N--CA 1.485 1.325 0 O-C-N 121.203 -0.935 . . . . 0.0 109.603 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.527 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -72.28 50.83 0.23 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.191 -0.943 . . . . 0.0 110.714 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 5' ' ' THR . 21.2 m 79.41 71.73 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 175.57 37.85 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.368 -0.832 . . . . 0.0 110.457 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -79.83 63.82 4.49 Favored 'General case' 0 C--N 1.296 -1.724 0 C-N-CA 118.876 -1.13 . . . . 0.0 109.082 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.494 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.644 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.712 HG11 ' CD2' ' A' ' 29' ' ' PHE . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.552 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.753 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.469 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.469 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.3 t30 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB2' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.735 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.756 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.415 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.586 HG23 ' HB ' ' A' ' 36' ' ' ILE . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.586 ' HB ' HG23 ' A' ' 34' ' ' THR . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 -145.66 118.07 8.49 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.496 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.7 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.297 1.3 mtm180 -85.0 177.94 2.66 Favored Pre-proline 0 C--N 1.284 -2.276 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 177.894 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.702 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.753 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.499 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.644 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.685 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.5 m-70 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.52 ' HB1' ' OP2' ' C' ' 235' ' ' ' DT' . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.534 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.644 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.735 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.582 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.738 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.6 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.418 ' HB2' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HG3' ' CD2' ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.784 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.511 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.568 ' NH2' ' O2 ' ' C' ' 231' ' ' ' DT' 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.698 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.997 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.7 m120 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.997 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 124' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.711 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.903 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.711 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.903 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.446 ' CD1' ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CG1' ' A' ' 100' ' ' VAL . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.74 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.595 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.631 ' CG1' HD22 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.426 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.434 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.44 ' HB3' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.498 ' HA ' ' CE ' ' A' ' 111' ' ' MET . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.659 ' HB ' ' SD ' ' A' ' 111' ' ' MET . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.577 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.659 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.456 ' O ' ' CE ' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.432 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.78 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.538 ' HB2' ' CE ' ' A' ' 111' ' ' MET . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.573 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.567 ' NH2' ' H42' ' C' ' 226' ' ' ' DC' . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.55 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.843 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.599 ' CG2' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.61 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.826 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.843 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.989 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.559 ' CB ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.826 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 135' ' ' TRP . 3.0 tt0 -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.756 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.74 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.161 1 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.564 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.584 3 C3'-C2'-C1' 113.67 7.836 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.629 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.322 2 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.649 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 1 C3'-C2'-C1' 115.138 8.884 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.559 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.742 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.09 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.76 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.411 -10.742 2 C3'-C2'-C1' 114.183 8.202 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.76 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.529 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.133 2 C3'-C2'-C1' 114.802 8.644 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.72 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.755 1 C3'-C2'-C1' 115.209 8.935 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.72 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.955 2 C3'-C2'-C1' 114.642 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.78 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.561 1 C3'-C2'-C1' 114.639 8.528 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.767 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.667 1 C3'-C2'-C1' 114.402 8.359 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.623 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.744 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.562 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.36 2 C3'-C2'-C1' 115.623 9.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.562 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.896 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.652 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.7 2 C3'-C2'-C1' 114.645 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.652 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.601 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.235 2 C3'-C2'-C1' 114.461 8.4 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.601 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.314 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.709 H2'' " O5'" ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.42 -9.756 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.989 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.367 1 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.525 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.421 -9.745 1 C3'-C2'-C1' 114.835 8.668 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.696 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.073 2 C3'-C2'-C1' 114.596 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.696 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.951 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.634 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.841 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.577 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.508 1 C3'-C2'-C1' 114.892 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.59 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.999 1 C3'-C2'-C1' 114.816 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.703 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.874 2 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.703 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.205 2 C3'-C2'-C1' 114.976 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.784 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.423 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.685 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.834 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.574 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.69 1 C3'-C2'-C1' 115.539 9.171 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.532 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.38 2 C3'-C2'-C1' 114.834 8.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.532 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.639 2 C3'-C2'-C1' 114.609 8.506 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.526 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.351 2 C3'-C2'-C1' 114.259 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' O ' ' N ' ' A' ' 3' ' ' LYS . 3.4 mtm . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.178 0.513 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.65 -72.44 0.06 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.51 -0.743 . . . . 0.0 110.658 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 1' ' ' MET . 7.6 mtmt -157.29 114.87 3.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.967 -1.083 . . . . 0.0 110.645 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.67 -154.89 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.262 -0.899 . . . . 0.0 109.105 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.579 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 m -70.33 41.47 0.05 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.104 -0.997 . . . . 0.0 110.876 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.579 ' HB2' ' O ' ' A' ' 5' ' ' THR . 33.1 m 79.35 53.81 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.786 -0.571 . . . . 0.0 109.951 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -147.47 1.19 0.71 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.354 -0.841 . . . . 0.0 111.954 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 9' ' ' ASP . 63.5 m -80.23 64.5 5.07 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 120.597 -1.315 . . . . 0.0 108.613 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.473 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.659 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.621 ' CD1' ' HD3' ' A' ' 49' ' ' ARG . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.777 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.55 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.681 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.464 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.795 ' O ' ' N ' ' A' ' 78' ' ' ASN 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 56' ' ' ALA . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 61' ' ' ALA . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.721 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.407 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.559 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.484 ' CD1' " H3'" ' C' ' 233' ' ' ' DA' . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 -147.58 116.46 6.79 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.468 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.766 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.1 178.23 1.7 Allowed Pre-proline 0 C--N 1.289 -2.063 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.777 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.681 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.535 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.887 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.1 m-70 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.578 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.794 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.566 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.556 ' HB2' HG23 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.542 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.457 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.6 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.406 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.416 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.613 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.792 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.98 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.98 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.792 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.653 HD12 ' HB ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.77 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.77 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.497 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.612 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.612 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.446 HD23 ' CG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.565 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.565 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.632 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.485 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.522 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.53 ' CZ ' ' H72' ' C' ' 223' ' ' ' DT' . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.885 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.448 ' HA ' ' SD ' ' A' ' 111' ' ' MET . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.524 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.452 HD21 ' OG1' ' A' ' 123' ' ' THR . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.698 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.729 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.464 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.653 ' HB ' HD12 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.814 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.729 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.843 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.505 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.814 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.406 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.532 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.567 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.287 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.567 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.675 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.652 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.918 1 C3'-C2'-C1' 115.032 8.809 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.703 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.087 1 C3'-C2'-C1' 115.1 8.857 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.703 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.735 2 C3'-C2'-C1' 114.636 8.525 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.684 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.954 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.731 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.824 2 C3'-C2'-C1' 114.049 8.106 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.731 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.5 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.752 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.94 1 C3'-C2'-C1' 115.251 8.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.752 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.672 8.551 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.885 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.414 -10.392 1 C3'-C2'-C1' 114.819 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.762 H2'' " O5'" ' B' ' 203' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.762 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.718 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.649 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.254 2 C3'-C2'-C1' 115.683 9.274 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.627 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.822 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.575 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.51 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.344 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C4 ' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.452 2 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.598 ' P ' ' HD3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.202 1 C3'-C2'-C1' 114.628 8.52 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.843 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.413 -10.487 1 C3'-C2'-C1' 114.889 8.707 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.545 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.09 1 C3'-C2'-C1' 114.993 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.743 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.835 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.743 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.413 -10.499 2 C3'-C2'-C1' 115.013 8.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.537 ' H6 ' " H2'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.913 2 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.57 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.377 1 C3'-C2'-C1' 114.856 8.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.57 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 1 C3'-C2'-C1' 114.811 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.699 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.851 2 C3'-C2'-C1' 114.861 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.699 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.62 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.403 -11.465 1 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.887 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.414 -10.408 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.578 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.412 -10.624 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.557 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.741 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.488 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.922 2 C3'-C2'-C1' 114.585 8.49 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.488 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.431 2 C3'-C2'-C1' 114.299 8.285 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.234 0.54 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.423 ' CB ' HG21 ' A' ' 8' ' ' THR . 31.6 mmtp -98.44 115.68 29.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.328 -0.857 . . . . 0.0 109.926 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -141.29 82.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.297 -0.877 . . . . 0.0 110.631 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.23 -154.94 0.65 Allowed 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.223 -0.923 . . . . 0.0 110.09 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.559 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -134.2 87.0 2.32 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.327 -0.858 . . . . 0.0 109.423 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.9 OUTLIER 79.63 24.93 0.42 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.451 0.643 . . . . 0.0 109.468 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 30.7 mt -119.71 -24.29 6.24 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.63 -0.669 . . . . 0.0 110.026 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.434 ' O ' ' C ' ' A' ' 9' ' ' ASP . 21.1 m -79.78 64.57 4.68 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 8' ' ' THR . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.508 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.556 ' O ' HG21 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.609 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.508 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.747 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.564 HD13 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.694 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.4 t30 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.541 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.569 HG22 ' HB2' ' A' ' 61' ' ' ALA . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.745 ' CD2' HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.741 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.446 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.45 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.409 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.578 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.661 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.2 p90 -145.7 116.59 7.76 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.443 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 -89.21 178.18 2.14 Favored Pre-proline 0 C--N 1.279 -2.48 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.001 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.694 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.436 ' NH2' ' N3 ' ' B' ' 197' ' ' ' DA' . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.707 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.817 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.4 m-70 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.579 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.539 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.741 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.609 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.555 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.484 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.551 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.593 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB2' ' CE2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.497 ' HD3' ' CD2' ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.833 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.618 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.709 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.993 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.993 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 25.3 m170 -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.553 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.733 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.957 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.733 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.957 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.658 HD21 ' HG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.545 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.635 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.635 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.545 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.658 ' HG1' HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.421 HD21 ' CB ' ' A' ' 113' ' ' PRO . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.566 ' HB ' ' HG2' ' A' ' 111' ' ' MET . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.562 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.566 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.424 ' CE1' ' NZ ' ' A' ' 129' ' ' LYS . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.867 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.432 ' C ' ' CD1' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.536 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.433 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.657 ' CE2' HG21 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.873 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.553 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.574 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.745 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.873 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 1.122 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.645 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.745 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 135' ' ' TRP . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.769 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.329 1 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.652 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.581 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.13 1 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.67 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.688 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.817 2 C3'-C2'-C1' 114.57 8.478 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.689 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.047 2 C3'-C2'-C1' 114.236 8.24 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.726 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.803 2 C3'-C2'-C1' 114.195 8.211 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.726 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.57 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.152 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.735 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.812 1 C3'-C2'-C1' 115.291 8.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.735 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.353 2 C3'-C2'-C1' 114.654 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.867 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.408 -11.024 1 C3'-C2'-C1' 114.632 8.523 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.774 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.75 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.701 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.646 2 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.567 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.171 2 C3'-C2'-C1' 115.653 9.252 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.567 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.678 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.574 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.822 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.574 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.27 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.693 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.968 2 C3'-C2'-C1' 114.501 8.429 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.693 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.959 1 C3'-C2'-C1' 114.595 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.545 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.065 2 C3'-C2'-C1' 114.777 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 1.122 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.246 1 C3'-C2'-C1' 114.994 8.781 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.571 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.942 1 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.571 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.927 1 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.632 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.234 2 C3'-C2'-C1' 115.283 8.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.632 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.64 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.635 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.398 1 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.635 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.057 2 C3'-C2'-C1' 114.795 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.679 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.792 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.386 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.833 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.176 2 C3'-C2'-C1' 114.404 8.36 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.817 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.844 1 C3'-C2'-C1' 114.76 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.707 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.724 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.545 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.239 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.545 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.705 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.48 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.489 2 C3'-C2'-C1' 114.36 8.329 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 tpt . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.093 0.473 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -169.78 -38.2 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.298 -0.876 . . . . 0.0 110.716 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -100.5 149.91 23.21 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.665 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.472 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -92.21 -154.67 0.39 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.366 -0.834 . . . . 0.0 108.786 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.565 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -69.81 41.47 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.088 -1.008 . . . . 0.0 110.72 179.849 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 5' ' ' THR . 34.1 m 79.49 50.43 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.77 -0.581 . . . . 0.0 110.072 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -172.12 39.79 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 O-C-N 121.366 -0.834 . . . . 0.0 111.536 -179.403 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.6 m -79.75 64.07 4.5 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.209 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.471 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.495 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.653 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.754 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.775 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.621 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.562 HG21 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.717 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.514 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.43 HG21 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.597 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.8 p90 -146.95 117.84 7.65 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.488 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 -95.54 178.11 1.56 Allowed Pre-proline 0 C--N 1.277 -2.586 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.754 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.775 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.508 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.7 m-70 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.605 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.783 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.653 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.711 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.7 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.544 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB1' HG21 ' A' ' 28' ' ' VAL . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.499 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.499 ' CE2' ' HB1' ' A' ' 64' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.641 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.615 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.592 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.641 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.548 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.694 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.015 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.015 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.653 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.729 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.465 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.661 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.435 ' HB3' ' HG1' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.489 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.512 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.512 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.491 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.435 ' HG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.481 ' HB3' HD23 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.463 ' CE ' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.486 ' CE1' ' OP2' ' C' ' 223' ' ' ' DT' . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.765 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.481 HD23 ' HB3' ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.53 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 77.2 m-70 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.451 ' NH2' ' N7 ' ' C' ' 225' ' ' ' DG' . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CE1' ' HB ' ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.923 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.569 ' CG2' HD23 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.648 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.644 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.814 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.923 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.864 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.814 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.433 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.661 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.489 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.505 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.403 -11.486 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.574 " O5'" " H2'" ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.401 -11.665 3 C3'-C2'-C1' 113.611 7.794 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.597 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.305 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.679 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.012 1 C3'-C2'-C1' 114.883 8.702 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.679 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.052 2 C3'-C2'-C1' 114.59 8.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.668 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.02 2 C3'-C2'-C1' 114.209 8.221 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.754 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.407 -11.112 1 C3'-C2'-C1' 114.291 8.279 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.754 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.829 8.663 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.516 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.998 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.681 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 115.123 8.874 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.681 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.765 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.661 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.775 H2'' " O5'" ' B' ' 203' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -10.975 1 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.775 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.57 2 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.612 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.241 2 C3'-C2'-C1' 115.705 9.29 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.653 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.689 2 C3'-C2'-C1' 114.951 8.751 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.526 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.612 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.157 2 C3'-C2'-C1' 114.381 8.344 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.612 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.486 ' OP2' ' CE1' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.416 -10.159 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.864 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.312 1 C3'-C2'-C1' 114.854 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.61 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.002 1 C3'-C2'-C1' 115.016 8.797 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.71 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.847 2 C3'-C2'-C1' 114.467 8.405 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.71 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.094 1 C3'-C2'-C1' 115.106 8.861 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.617 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.725 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.605 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.445 1 C3'-C2'-C1' 114.783 8.631 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.605 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.031 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.722 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.704 2 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.722 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.92 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.688 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.01 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.858 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.816 2 C3'-C2'-C1' 114.966 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.639 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.573 1 C3'-C2'-C1' 115.615 9.225 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.537 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.162 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.537 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.781 2 C3'-C2'-C1' 114.693 8.567 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.488 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.379 2 C3'-C2'-C1' 114.298 8.284 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.12 0.486 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 51.88 35.61 16.11 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.396 -0.815 . . . . 0.0 110.195 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.5 mtmt -54.06 132.94 43.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.418 -0.802 . . . . 0.0 110.474 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -111.21 -154.66 0.55 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 121.268 -0.895 . . . . 0.0 108.811 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.531 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 11.9 t -66.35 49.2 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.288 -0.882 . . . . 0.0 109.868 179.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.673 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 1.8 t 79.55 101.44 0.06 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.669 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.673 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 4.4 mt 94.57 80.28 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 122.108 0.956 . . . . 0.0 111.527 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ASP . 28.2 m -79.92 64.64 4.82 Favored 'General case' 0 C--N 1.291 -1.935 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 177.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.549 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.528 ' O ' HG21 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.678 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.549 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.999 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.583 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.616 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.668 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.496 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 1.2 t30 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 40' ' ' PRO . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.586 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.523 ' CA ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.798 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.605 HG22 ' HB3' ' A' ' 61' ' ' ALA . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.744 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.799 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.437 HG21 HG13 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.526 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.616 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 1.8 p90 -144.75 123.67 12.73 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.856 HCS1 ' CB ' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.647 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -72.34 178.42 1.38 Allowed Pre-proline 0 C--N 1.277 -2.577 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 176.031 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.999 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.668 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.856 ' CB ' HCS1 ' A' ' 38' ' ' SMC . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.708 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.618 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.979 ' HB3' " H4'" ' C' ' 234' ' ' ' DT' . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 1.177 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.509 ' HB2' HG12 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.518 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.799 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.1 m-20 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.678 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.744 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.585 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.522 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.713 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.534 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.571 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 38' ' ' SMC . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.518 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.45 ' CG ' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.693 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.936 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.8 m120 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.936 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.762 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.527 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.592 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.508 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.636 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.636 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.43 HG12 ' HG ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.538 HD13 ' HA ' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.569 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.446 ' HE1' HG22 ' A' ' 109' ' ' VAL . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.419 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.538 ' HA ' HD13 ' A' ' 102' ' ' LEU . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.858 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.0 t60 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.537 ' CB ' HD13 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.523 ' NH2' ' H42' ' C' ' 226' ' ' ' DC' . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.606 ' CE2' HG21 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.931 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.507 HG21 HD22 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.933 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.509 ' O ' ' OG1' ' A' ' 127' ' ' THR . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.862 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.931 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.992 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.862 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.592 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.426 ' HD3' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.565 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.258 1 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.565 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.658 3 C3'-C2'-C1' 113.859 7.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.557 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.03 1 C3'-C2'-C1' 115.004 8.788 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.562 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.043 8.816 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.601 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.848 1 C3'-C2'-C1' 114.742 8.602 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.702 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.439 8.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.771 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.005 8.075 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.771 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.663 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.83 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.653 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.685 1 C3'-C2'-C1' 115.135 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.383 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.858 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.408 -10.953 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.797 H2'' " O5'" ' B' ' 203' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.907 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.797 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.556 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.264 2 C3'-C2'-C1' 115.839 9.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.611 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.667 2 C3'-C2'-C1' 115.011 8.793 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.611 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.85 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.54 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.373 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.607 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.019 2 C3'-C2'-C1' 114.368 8.334 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.607 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.288 1 C3'-C2'-C1' 114.574 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.595 ' OP1' ' HE3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.209 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.992 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.205 1 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.567 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.298 1 C3'-C2'-C1' 115.038 8.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.651 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.905 1 C3'-C2'-C1' 114.318 8.298 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.651 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.114 1 C3'-C2'-C1' 115.309 9.006 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.622 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.755 2 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.567 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.658 1 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.58 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.912 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.742 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.828 2 C3'-C2'-C1' 114.86 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.742 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.355 2 C3'-C2'-C1' 114.843 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.577 ' N1 ' ' N1 ' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.689 2 C3'-C2'-C1' 114.125 8.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.979 " H4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 1.177 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.563 9.188 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.566 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 2 C3'-C2'-C1' 114.787 8.634 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.56 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.665 2 C3'-C2'-C1' 114.531 8.45 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.505 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.309 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.076 0.465 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.88 -44.14 0.48 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.484 -0.76 . . . . 0.0 111.405 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.76 118.64 2.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.971 -1.081 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -63.07 -154.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.425 -0.797 . . . . 0.0 110.011 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -71.83 41.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.214 -0.929 . . . . 0.0 111.208 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 79.53 94.12 0.05 Allowed 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.316 -0.865 . . . . 0.0 109.883 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.5 -19.73 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 111.477 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.4 HG23 ' CB ' ' A' ' 11' ' ' GLN . 21.1 m -79.79 64.23 4.58 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.735 -1.228 . . . . 0.0 109.292 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.483 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.499 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.689 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.74 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.753 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.753 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.439 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.439 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HB1' ' NH2' ' A' ' 12' ' ' ARG . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.705 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.499 HD13 HG21 ' A' ' 36' ' ' ILE . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 -146.99 119.58 8.52 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.502 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 -85.71 167.28 25.43 Favored Pre-proline 0 C--N 1.286 -2.155 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.74 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.671 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.477 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.46 ' HD3' " H5'" ' B' ' 199' ' ' ' DA' . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.601 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.866 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.683 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.532 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.689 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.555 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.555 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.572 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.446 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.711 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.507 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.624 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.524 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.512 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.769 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.0 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.0 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.45 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.442 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.512 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.802 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.738 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.912 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.912 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.561 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.48 ' CG1' HD22 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.664 HD11 ' HA ' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' CD2' HD23 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.563 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.563 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.401 ' HE1' HD21 ' A' ' 116' ' ' LEU . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.44 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.664 ' HA ' HD11 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.598 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.82 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.574 ' CB ' HD11 ' A' ' 102' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.486 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.612 ' NH2' ' H42' ' C' ' 226' ' ' ' DC' . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.659 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.854 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.53 HG21 HD23 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.802 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.599 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.599 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.857 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.854 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 1.025 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.457 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.857 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.858 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.858 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.534 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.301 1 C3'-C2'-C1' 114.709 8.578 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.534 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 2 C3'-C2'-C1' 113.764 7.903 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.58 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.988 1 C3'-C2'-C1' 114.873 8.695 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.638 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.638 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.05 2 C3'-C2'-C1' 114.738 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.799 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.97 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.799 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.833 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.716 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.037 2 C3'-C2'-C1' 114.922 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.601 8.501 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.68 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.77 1 C3'-C2'-C1' 115.132 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.68 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.982 2 C3'-C2'-C1' 114.517 8.441 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.82 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.721 1 C3'-C2'-C1' 114.617 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.781 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.818 1 C3'-C2'-C1' 114.616 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.739 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.58 2 C3'-C2'-C1' 114.679 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.641 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 115.729 9.306 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.641 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.596 2 C3'-C2'-C1' 114.858 8.684 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.574 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.422 -9.63 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.553 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.201 2 C3'-C2'-C1' 114.733 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.492 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.349 2 C3'-C2'-C1' 114.337 8.312 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.637 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.272 2 C3'-C2'-C1' 114.644 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.637 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 1.025 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.417 -10.119 1 C3'-C2'-C1' 114.929 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.564 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.025 1 C3'-C2'-C1' 114.999 8.785 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.749 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -10.041 2 C3'-C2'-C1' 114.578 8.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.749 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.965 1 C3'-C2'-C1' 115.241 8.958 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.636 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.824 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.435 1 C3'-C2'-C1' 114.728 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.608 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.03 2 C3'-C2'-C1' 114.713 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.716 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.009 2 C3'-C2'-C1' 114.946 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.716 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.446 2 C3'-C2'-C1' 115.073 8.838 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.711 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.384 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.866 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.709 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.684 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.717 2 C3'-C2'-C1' 115.561 9.186 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.542 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.4 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.542 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.714 2 C3'-C2'-C1' 114.518 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.53 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.455 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.37 0.605 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -129.88 167.56 17.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.271 -0.893 . . . . 0.0 110.072 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.9 123.15 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.264 -0.898 . . . . 0.0 110.242 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -82.34 -158.65 0.26 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.284 -0.885 . . . . 0.0 109.901 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.567 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -75.27 51.63 0.56 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.27 -0.894 . . . . 0.0 110.813 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.567 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.7 t 79.55 68.45 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.593 -0.692 . . . . 0.0 109.978 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.07 30.06 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.318 -0.864 . . . . 0.0 111.003 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.6 m -104.98 64.16 0.72 Allowed 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.219 -0.993 . . . . 0.0 109.294 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.49 ' HA ' ' HG3' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.511 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.646 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.511 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 3.9 tt0 -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.753 HG13 ' CD2' ' A' ' 29' ' ' PHE . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.491 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.3 t30 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.402 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.762 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.591 ' N ' ' HB3' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.483 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.753 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.734 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.422 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.425 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.47 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.619 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.4 p90 -149.03 117.91 6.68 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.459 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER -87.26 171.73 9.34 Favored Pre-proline 0 C--N 1.286 -2.169 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 177.701 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.656 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.762 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.615 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 1.047 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.9 m-70 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.788 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.456 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.734 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.646 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.709 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.614 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.503 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.723 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.564 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.562 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.553 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.562 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.409 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.743 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.977 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.977 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.708 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.826 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.785 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.658 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.785 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.475 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 101' ' ' THR . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.571 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.538 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.571 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.576 ' O ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.484 ' HB3' ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.694 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.694 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.433 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.455 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.8 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.484 ' HG ' ' HB3' ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.489 ' CG ' ' HB2' ' A' ' 129' ' ' LYS . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.529 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.782 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.801 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.554 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.783 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.801 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.926 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.683 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.783 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.477 ' HG3' ' HA ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 135' ' ' TRP 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.514 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.509 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.346 1 C3'-C2'-C1' 114.686 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.582 " O5'" " H2'" ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.402 -11.641 3 C3'-C2'-C1' 113.615 7.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.627 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 115.181 8.915 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.627 " O5'" H2'' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.177 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.547 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.057 2 C3'-C2'-C1' 114.576 8.483 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.81 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.036 2 C3'-C2'-C1' 114.162 8.187 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.81 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.413 -10.534 2 C3'-C2'-C1' 114.111 8.151 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.754 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.251 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.56 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.634 8.524 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.709 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.814 1 C3'-C2'-C1' 115.18 8.914 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.709 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.183 1 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.8 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.796 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 114.595 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.79 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.673 8.552 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.593 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.208 2 C3'-C2'-C1' 115.875 9.411 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.593 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.716 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.631 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.716 2 C3'-C2'-C1' 114.851 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.631 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.377 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.4 ' H6 ' " H2'" ' C' ' 221' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.405 -11.33 2 C3'-C2'-C1' 114.385 8.346 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.574 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.42 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.574 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.133 1 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.926 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.422 1 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.582 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.15 1 C3'-C2'-C1' 115.052 8.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.582 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.967 1 C3'-C2'-C1' 114.435 8.382 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.626 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.349 1 C3'-C2'-C1' 115.311 9.008 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.626 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.674 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.585 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.371 1 C3'-C2'-C1' 114.882 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.585 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.71 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.865 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.71 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.164 2 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.606 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.404 -11.43 1 C3'-C2'-C1' 114.581 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 1.047 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.68 2 C3'-C2'-C1' 114.881 8.7 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.788 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.411 -10.684 1 C3'-C2'-C1' 115.485 9.132 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.579 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.78 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.516 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.393 2 C3'-C2'-C1' 114.242 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -140.73 -164.23 1.69 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.332 -0.855 . . . . 0.0 110.222 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -108.8 -165.13 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.368 -0.832 . . . . 0.0 110.311 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.752 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -148.36 -154.17 0.54 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.402 -0.811 . . . . 0.0 109.072 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.542 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.4 m -55.15 46.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.487 -0.758 . . . . 0.0 111.931 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.752 ' N ' ' O ' ' A' ' 4' ' ' ALA . 1.4 t 79.56 96.11 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.527 -0.733 . . . . 0.0 112.36 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 1.4 mt 80.46 77.67 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 121.991 0.9 . . . . 0.0 112.444 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.532 ' OG1' ' CB ' ' A' ' 4' ' ' ALA . 20.3 m -86.66 63.44 7.98 Favored 'General case' 0 C--N 1.289 -2.026 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 176.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.479 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.685 ' N ' ' HD2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.586 ' NE1' HD13 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.479 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.77 HG12 ' CD2' ' A' ' 29' ' ' PHE . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.586 HD13 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.461 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.461 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 1.2 t30 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.606 HG23 ' HB3' ' A' ' 61' ' ' ALA . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.77 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.746 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.441 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.458 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.711 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -148.06 116.65 6.64 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.446 ' SG ' ' CB ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 -86.83 178.15 2.41 Favored Pre-proline 0 C--N 1.285 -2.21 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 177.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.704 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.691 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.403 ' NH2' ' N3 ' ' B' ' 197' ' ' ' DA' . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.748 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.73 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.1 m-70 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.662 ' HA ' ' OP1' ' C' ' 235' ' ' ' DT' . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.541 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.746 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.581 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.703 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.634 ' CE2' ' HA ' ' A' ' 61' ' ' ALA . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.516 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.737 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.556 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.418 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.737 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB1' ' CD1' ' A' ' 66' ' ' PHE . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.522 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.461 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.511 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.783 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.981 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.981 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.708 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.41 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.559 HD22 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.789 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.62 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.789 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.62 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.672 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.522 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.672 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.498 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.426 ' HB3' HD21 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.445 ' CA ' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.568 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.568 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.555 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.652 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.544 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.807 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.588 ' HG ' ' N ' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.588 ' N ' ' HG ' ' A' ' 116' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.579 ' HD3' ' O6 ' ' B' ' 202' ' ' ' DG' . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.453 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.674 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.659 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.559 ' CG2' HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.547 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.839 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.659 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.519 ' CB ' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.573 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.839 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.462 ' NE2' ' CE1' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 92' ' ' ARG . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.256 1 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.558 3 C3'-C2'-C1' 113.519 7.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.605 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.915 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.686 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.053 2 C3'-C2'-C1' 114.897 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.686 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.679 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.715 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.075 2 C3'-C2'-C1' 114.338 8.313 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.732 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.766 1 C3'-C2'-C1' 114.1 8.143 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.732 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.895 8.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.513 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.933 2 C3'-C2'-C1' 114.654 8.539 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.703 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.729 1 C3'-C2'-C1' 115.036 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.703 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.943 2 C3'-C2'-C1' 114.603 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.807 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.614 1 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.778 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.626 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.738 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.879 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.643 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 115.693 9.28 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.643 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.864 2 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.637 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.828 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.518 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.268 2 C3'-C2'-C1' 114.823 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.543 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.404 -11.383 2 C3'-C2'-C1' 114.455 8.397 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.543 ' N4 ' ' C4 ' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.552 H2'' " O5'" ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.139 1 C3'-C2'-C1' 114.725 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.864 ' H73' ' OP2' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.612 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.636 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.715 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.715 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.958 1 C3'-C2'-C1' 115.267 8.976 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.644 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.697 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.606 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.463 1 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.606 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.072 2 C3'-C2'-C1' 114.662 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.74 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.027 2 C3'-C2'-C1' 114.731 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.74 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.236 2 C3'-C2'-C1' 114.916 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.598 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.7 2 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.793 H2'' " O5'" ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.511 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.793 " O5'" H2'' ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 115.593 9.209 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.54 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.685 2 C3'-C2'-C1' 114.624 8.517 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.452 " C5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.47 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' A' ' 2' ' ' LYS . 20.5 mtt . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.06 0.457 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' CB ' ' O ' ' A' ' 1' ' ' MET . 20.3 tttm 68.72 -1.77 1.89 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 111.206 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp 46.57 57.8 5.16 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.089 -1.007 . . . . 0.0 111.338 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.91 163.74 13.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.149 -0.969 . . . . 0.0 110.089 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.9 p -99.88 72.1 1.7 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.357 -0.84 . . . . 0.0 109.583 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 5' ' ' THR . 2.4 t 79.77 25.88 0.38 Allowed 'General case' 0 N--CA 1.499 2.011 0 CA-C-O 121.28 0.562 . . . . 0.0 109.54 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 mt -110.09 -44.25 3.81 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.402 -0.811 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.555 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 62.8 m -81.62 63.51 5.93 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.827 -1.149 . . . . 0.0 108.107 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.492 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.488 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.488 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.724 HG13 ' CD2' ' A' ' 29' ' ' PHE . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.556 ' CD2' ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.568 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.66 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 1.2 t30 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.578 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.728 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.786 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.419 HG21 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.539 HG22 ' HB ' ' A' ' 36' ' ' ILE . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.539 ' HB ' HG22 ' A' ' 34' ' ' THR . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.728 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 -148.82 118.63 7.08 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.551 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 -79.55 165.17 49.79 Favored Pre-proline 0 C--N 1.291 -1.955 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.707 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.66 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.551 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.456 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.3 m-70 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.673 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.516 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.1 m-20 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.681 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.559 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.568 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.515 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.584 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.438 ' HB1' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.438 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.599 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.561 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.547 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.771 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.968 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.968 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.771 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.449 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.528 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.794 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.671 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.794 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.671 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.491 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.527 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.419 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.491 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.579 ' O ' HD11 ' A' ' 105' ' ' LEU . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.713 HD12 ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.584 ' N ' HD11 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.564 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.564 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.474 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.493 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' OP2' ' C' ' 223' ' ' ' DT' . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.942 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.713 ' HG ' HD12 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.483 ' CD2' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.424 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.5 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.767 ' CE1' HG23 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.725 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.528 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.476 ' HA ' HD22 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.895 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.725 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.628 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.45 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.895 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.517 ' OE1' ' HA ' ' A' ' 91' ' ' CYS . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.492 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.212 1 C3'-C2'-C1' 114.761 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.519 " O5'" " H2'" ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.402 -11.635 3 C3'-C2'-C1' 113.641 7.815 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.607 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.88 1 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.658 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.228 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.658 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.062 2 C3'-C2'-C1' 114.809 8.649 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.724 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.419 -9.938 2 C3'-C2'-C1' 114.111 8.15 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.745 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.835 2 C3'-C2'-C1' 114.168 8.192 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.745 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.025 2 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.542 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.833 2 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.718 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.594 1 C3'-C2'-C1' 115.236 8.954 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.718 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.942 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.723 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.79 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.551 8.465 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.757 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 2 C3'-C2'-C1' 114.477 8.412 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.615 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.653 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 114.943 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.64 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.712 8.58 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.406 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.27 2 C3'-C2'-C1' 114.149 8.178 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.443 ' C6 ' ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.327 2 C3'-C2'-C1' 114.538 8.456 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.496 ' OP2' ' CE1' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.416 -10.156 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.85 ' OP2' ' H72' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.414 1 C3'-C2'-C1' 114.878 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.582 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.038 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.596 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.226 2 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.678 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.065 1 C3'-C2'-C1' 115.249 8.963 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.678 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.629 2 C3'-C2'-C1' 114.629 8.521 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.57 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.339 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.588 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.146 2 C3'-C2'-C1' 114.802 8.645 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.706 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.784 2 C3'-C2'-C1' 114.9 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.706 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.408 2 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.629 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.211 1 C3'-C2'-C1' 114.566 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.858 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.412 -10.594 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.673 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.41 -10.762 2 C3'-C2'-C1' 115.483 9.131 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.54 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.246 2 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.558 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.504 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.558 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.444 2 C3'-C2'-C1' 114.273 8.266 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 ttp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.212 0.53 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -106.06 150.81 25.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -169.32 156.05 6.68 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.428 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.625 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -129.13 -154.37 0.63 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.555 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 10.1 t -62.19 46.8 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.349 -0.844 . . . . 0.0 110.357 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.668 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 35.1 m 79.62 107.16 0.07 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.92 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 6.1 mt 93.81 75.83 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 CA-C-O 121.837 0.827 . . . . 0.0 113.161 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.579 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m -97.16 64.26 1.93 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 175.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.455 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.579 ' HD2' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.596 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.79 HG13 ' CD2' ' A' ' 29' ' ' PHE . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.582 HD13 ' CD1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.432 ' C ' HD22 ' A' ' 78' ' ' ASN 0.3 1.2 t30 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.669 ' N ' ' HB3' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.628 HG22 ' HB3' ' A' ' 61' ' ' ALA . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.79 ' CD2' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.539 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.697 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.433 HG22 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.446 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.48 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.712 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 -148.96 115.76 5.98 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.504 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 -93.94 178.35 1.59 Allowed Pre-proline 0 C--N 1.287 -2.143 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.633 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.482 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.689 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.689 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 1.051 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.0 m-70 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.529 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.697 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.596 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.674 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.525 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.522 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.549 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.628 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.56 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.428 ' HG2' ' OP1' ' C' ' 232' ' ' ' DA' . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.464 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.627 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.564 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.737 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.012 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.012 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.645 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.557 HD13 ' HB ' ' A' ' 124' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.77 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.65 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.77 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.65 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.666 HD12 ' OG1' ' A' ' 101' ' ' THR . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.504 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.442 ' O ' ' HG3' ' A' ' 95' ' ' GLU . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.609 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.609 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.424 ' CG1' HD21 ' A' ' 94' ' ' LEU . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 113' ' ' PRO . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.42 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' ' SD ' ' A' ' 111' ' ' MET . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.629 ' HB ' ' SD ' ' A' ' 111' ' ' MET . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.563 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.629 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.465 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.606 ' CZ ' ' H71' ' C' ' 223' ' ' ' DT' . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.802 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CB ' HD13 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.447 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.457 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.487 HD23 ' OG1' ' A' ' 123' ' ' THR . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.748 ' CZ ' HG23 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.74 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.487 ' OG1' HD23 ' A' ' 119' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.557 ' HB ' HD13 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.818 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.74 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.622 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.669 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.818 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.426 ' NE2' ' CD2' ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.466 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.529 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.327 1 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.529 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.403 -11.548 2 C3'-C2'-C1' 113.542 7.744 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.647 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.881 1 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.648 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.664 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.855 2 C3'-C2'-C1' 114.664 8.546 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.684 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.039 2 C3'-C2'-C1' 114.268 8.263 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.744 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.906 1 C3'-C2'-C1' 114.128 8.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.744 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.821 8.658 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.557 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.773 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.707 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.722 1 C3'-C2'-C1' 115.192 8.923 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.707 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.659 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.802 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.624 1 C3'-C2'-C1' 114.649 8.535 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.797 H2'' " O5'" ' B' ' 203' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.048 1 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.797 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.604 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.191 2 C3'-C2'-C1' 115.827 9.376 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.647 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.636 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.647 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.92 2 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.566 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.335 2 C3'-C2'-C1' 114.762 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.518 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.303 2 C3'-C2'-C1' 114.379 8.342 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.518 ' C6 ' ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.434 2 C3'-C2'-C1' 114.602 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.632 H2'' " O5'" ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.857 1 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.688 " O5'" ' H6 ' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.4 1 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.605 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 115.062 8.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.605 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.991 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.649 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.203 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.649 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.701 2 C3'-C2'-C1' 114.7 8.571 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.587 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.409 1 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.587 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.719 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.936 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.719 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.613 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.404 -11.426 1 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 1.051 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.711 2 C3'-C2'-C1' 114.859 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.553 H2'' " O5'" ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 115.497 9.141 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.553 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.372 2 C3'-C2'-C1' 114.753 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.529 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.719 2 C3'-C2'-C1' 114.525 8.446 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 114.312 8.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.228 0.537 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -151.6 -57.75 0.15 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.325 -0.86 . . . . 0.0 110.148 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt 56.48 166.4 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.521 -0.737 . . . . 0.0 110.547 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -112.92 -154.67 0.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.133 -0.979 . . . . 0.0 108.513 179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.554 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.5 m -66.8 48.28 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.201 -0.937 . . . . 0.0 110.037 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.554 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.3 t 79.51 40.15 0.09 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.749 -0.594 . . . . 0.0 109.589 -179.204 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.493 ' CG ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 168.19 75.93 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.678 0.752 . . . . 0.0 110.819 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 4' ' ' ALA . 21.3 m -80.03 63.56 4.58 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.652 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.713 HG12 ' CD2' ' A' ' 29' ' ' PHE . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.742 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 1.2 t30 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.637 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.58 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.613 HG23 ' HB1' ' A' ' 61' ' ' ALA . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.758 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.558 HG21 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 37' ' ' PHE . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 -148.46 118.1 7.04 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 -84.43 170.08 14.83 Favored Pre-proline 0 C--N 1.287 -2.13 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 177.441 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.677 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.742 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.539 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.582 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.812 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.9 m-70 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.555 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.537 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.758 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.652 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.716 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.73 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.492 ' CE2' ' HB1' ' A' ' 64' ' ' ALA . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.641 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.524 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.461 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.641 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.427 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.736 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.0 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.0 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.719 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.758 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.719 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.758 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.539 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.516 ' HG ' ' CG1' ' A' ' 100' ' ' VAL . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.527 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.583 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.583 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.516 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.539 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.675 ' CD2' ' NE2' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.423 ' CB ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.556 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.516 ' HG3' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.408 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.459 ' O ' ' CE1' ' A' ' 117' ' ' HIS . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.603 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.845 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 102' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CG ' HG21 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.627 ' HB2' ' CD ' ' A' ' 128' ' ' PRO 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.581 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.433 ' CG2' ' O ' ' A' ' 120' ' ' PHE . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.608 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.876 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.627 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.884 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.876 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 91' ' ' CYS . 0.9 OUTLIER -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.462 ' HA ' ' HE3' ' A' ' 135' ' ' TRP 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.527 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.322 1 C3'-C2'-C1' 114.703 8.574 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.765 3 C3'-C2'-C1' 113.655 7.825 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.664 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.945 1 C3'-C2'-C1' 114.891 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.685 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.158 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.687 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.745 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.976 2 C3'-C2'-C1' 114.18 8.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.747 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.858 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.747 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.975 2 C3'-C2'-C1' 114.949 8.749 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.539 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.863 2 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.726 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.661 1 C3'-C2'-C1' 115.142 8.887 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.726 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.104 2 C3'-C2'-C1' 114.67 8.55 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.845 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.409 -10.874 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.81 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.819 1 C3'-C2'-C1' 114.558 8.47 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.753 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.529 2 C3'-C2'-C1' 114.653 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.623 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.639 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.773 2 C3'-C2'-C1' 114.954 8.753 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.639 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.804 2 C3'-C2'-C1' 114.904 8.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.541 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.584 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.397 8.355 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.584 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.564 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.759 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.714 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 1.054 ' H73' ' OP2' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.436 1 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.647 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.042 1 C3'-C2'-C1' 114.938 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.647 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.499 8.428 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.631 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.138 1 C3'-C2'-C1' 115.259 8.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.631 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.643 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.608 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.104 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.695 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.933 2 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.695 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 115.189 8.921 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.617 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.622 8.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.812 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.674 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.555 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.494 9.139 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.517 H2'' " O5'" ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.263 2 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.517 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.785 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.493 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.429 2 C3'-C2'-C1' 114.287 8.276 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptp . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.149 0.5 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' C ' ' HG3' ' A' ' 3' ' ' LYS . 10.3 mmtp -84.57 -169.82 2.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.269 -0.894 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.758 ' O ' ' N ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -139.25 86.42 2.13 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.404 -0.81 . . . . 0.0 110.633 -179.537 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.566 ' HA ' ' H ' ' A' ' 8' ' ' THR . . . -39.39 72.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.549 -0.719 . . . . 0.0 112.824 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.758 ' N ' ' O ' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -73.69 70.49 1.37 Allowed 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 177.601 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.647 ' HB2' ' O ' ' A' ' 5' ' ' THR . 68.3 m 95.17 28.19 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.567 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER 81.47 88.97 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 123.951 1.834 . . . . 0.0 111.341 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.566 ' H ' ' HA ' ' A' ' 4' ' ' ALA . 19.2 m -79.59 64.66 4.53 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 112.015 -2.357 . . . . 0.0 106.972 177.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.573 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.521 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.577 ' CZ3' HG13 ' A' ' 52' ' ' VAL . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.521 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.71 HG12 ' CD2' ' A' ' 29' ' ' PHE . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.695 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.1 t30 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.549 ' C ' ' HG3' ' A' ' 40' ' ' PRO . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.961 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.658 ' N ' ' HB2' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.633 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.605 HG23 ' HB1' ' A' ' 61' ' ' ALA . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.71 ' CD2' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.814 ' HA ' ' O ' ' A' ' 51' ' ' ASN . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.424 HG23 ' CG1' ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 -145.67 118.22 8.56 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SMC . . . . . 0.52 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.961 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 -83.71 178.11 2.61 Favored Pre-proline 0 C--N 1.285 -2.196 0 CA-C-N 113.485 -1.689 . . . . 0.0 106.75 178.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.705 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.695 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.565 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.671 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.921 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.3 m-70 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.624 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.543 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.577 HG13 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.673 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.633 ' O ' ' HA ' ' A' ' 27' ' ' PHE . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.7 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.55 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CE1' ' A' ' 66' ' ' PHE . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.521 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.492 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.716 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.663 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.739 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 1.01 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 1.01 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 87' ' ' ILE . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.579 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.56 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.486 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.467 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.557 ' O ' ' CB ' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.557 ' CB ' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' MET . . . . . 0.412 ' SD ' ' CG1' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.432 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.526 ' CE1' ' OP2' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.71 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.505 ' NH2' ' H42' ' C' ' 226' ' ' ' DC' . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.401 ' HG ' HG12 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.564 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.915 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.554 ' CG2' ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.678 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.776 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' PRO . . . . . 0.915 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.952 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.502 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.776 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.483 ' O ' ' SG ' ' A' ' 91' ' ' CYS . 3.6 tm0? -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' TRP . . . . . 0.74 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.579 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 190' ' ' ' DG' . . . . . 0.494 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.222 1 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 191' ' ' ' DC' . . . . . 0.494 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.662 2 C3'-C2'-C1' 113.621 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 192' ' ' ' DA' . . . . . 0.632 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.884 1 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 193' ' ' ' DA' . . . . . 0.68 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.204 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 194' ' ' ' DA' . . . . . 0.68 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.723 2 C3'-C2'-C1' 114.762 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 195' ' ' ' DT' . . . . . 0.708 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.056 2 C3'-C2'-C1' 114.238 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 196' ' ' ' DT' . . . . . 0.768 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.966 1 C3'-C2'-C1' 114.241 8.243 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 197' ' ' ' DA' . . . . . 0.768 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.084 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 198' ' ' ' DA' . . . . . 0.515 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.943 1 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' ' DA' . . . . . 0.696 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.76 1 C3'-C2'-C1' 115.136 8.883 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' ' DG' . . . . . 0.696 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.962 2 C3'-C2'-C1' 114.544 8.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' ' DC' . . . . . 0.814 H2'' " O5'" ' B' ' 202' ' ' ' DG' . . . . . . . . 3 C3'--C2' 1.409 -10.903 1 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . 0.814 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.862 1 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' ' DC' . . . . . 0.76 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.509 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . 0.607 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 115.811 9.365 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . 0.607 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 114.901 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' ' DG' . . . . . 0.59 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.731 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' ' DA' . . . . . 0.569 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.3 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . 0.467 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.244 2 C3'-C2'-C1' 114.182 8.202 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . 0.496 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.252 2 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 223' ' ' ' DT' . . . . . 0.526 ' OP2' ' CE1' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.417 -10.07 1 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 224' ' ' ' DT' . . . . . 0.952 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.278 1 C3'-C2'-C1' 114.82 8.657 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 225' ' ' ' DG' . . . . . 0.603 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.045 1 C3'-C2'-C1' 114.977 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 226' ' ' ' DC' . . . . . 0.757 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.704 2 C3'-C2'-C1' 114.511 8.436 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 227' ' ' ' DG' . . . . . 0.757 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.955 1 C3'-C2'-C1' 115.133 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 228' ' ' ' DC' . . . . . 0.604 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.865 2 C3'-C2'-C1' 114.663 8.545 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 229' ' ' ' DT' . . . . . 0.585 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.424 1 C3'-C2'-C1' 114.915 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 230' ' ' ' DT' . . . . . 0.587 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.976 1 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 231' ' ' ' DT' . . . . . 0.708 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.879 2 C3'-C2'-C1' 114.87 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 232' ' ' ' DA' . . . . . 0.708 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 2 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 233' ' ' ' DA' . . . . . 0.657 " O5'" H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.405 -11.312 2 C3'-C2'-C1' 114.625 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 234' ' ' ' DT' . . . . . 0.921 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 114.843 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 235' ' ' ' DT' . . . . . 0.624 ' P ' ' HA ' ' A' ' 47' ' ' ALA . . . . . . . . 2 C3'--C2' 1.411 -10.675 2 C3'-C2'-C1' 115.505 9.147 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 236' ' ' ' DT' . . . . . 0.564 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.345 2 C3'-C2'-C1' 114.797 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 237' ' ' ' DG' . . . . . 0.525 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.408 -10.964 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' C' C ' 238' ' ' ' DC' . . . . . 0.521 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.384 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.4 m . . . . . 0 N--CA 1.465 0.302 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.574 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.57 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.837 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.57 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 12' ' ' ARG . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 12.8 t-20 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.775 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.775 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.754 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.99 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.99 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.68 HG22 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.69 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.78 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.659 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.659 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 48' ' ' LEU . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.617 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.775 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.744 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.606 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.749 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.55 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.629 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.732 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.732 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.482 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.51 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.632 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.9 m-20 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.724 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.875 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.997 HD23 ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.812 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 1.117 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.661 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.661 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.746 HG12 HD11 ' A' ' 102' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . 1.117 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.78 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.78 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 109' ' ' VAL . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.498 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.619 ' CB ' HD22 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.485 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.603 HD12 ' HE1' ' A' ' 111' ' ' MET . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.875 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.771 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.875 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.925 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.771 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.485 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.543 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.925 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.812 ' OE1' HD22 ' A' ' 94' ' ' LEU . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.565 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.418 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.798 HG22 ' H ' ' A' ' 11' ' ' GLN . 72.1 m . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.575 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.798 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.061 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.515 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.061 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.2 t-20 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.858 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.679 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.858 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.727 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.827 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.692 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.067 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.067 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.645 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.592 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.755 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.62 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.785 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.471 ' CZ ' ' NH2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.722 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.471 ' NE2' HG12 ' A' ' 16' ' ' VAL . 10.9 m80 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.659 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.79 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.681 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.827 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.727 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.612 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.681 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.447 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' NH2' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.706 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.736 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.97 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.0 m-20 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.97 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.985 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.709 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.87 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.87 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.585 HD23 ' OG1' ' A' ' 101' ' ' THR . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.678 ' HG ' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.466 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.541 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.767 HG12 ' CD1' ' A' ' 102' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.814 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.866 HD23 HD12 ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.744 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.543 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.543 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.744 ' HB2' ' SD ' ' A' ' 111' ' ' MET . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.866 HD12 HD23 ' A' ' 102' ' ' LEU . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.412 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.64 ' C ' HD13 ' A' ' 119' ' ' LEU . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.694 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.743 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.985 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.736 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.712 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.743 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.608 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.749 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.722 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.722 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.491 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.776 HG22 ' H ' ' A' ' 11' ' ' GLN . 94.0 m . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.776 ' H ' HG22 ' A' ' 8' ' ' THR . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.869 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.579 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.869 HG23 ' O ' ' A' ' 12' ' ' ARG . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.649 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 11.6 t-20 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.851 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.762 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.824 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.769 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.81 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.983 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.983 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.775 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.76 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 . . . . . 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.941 ' HD3' ' HB2' ' A' ' 77' ' ' ALA 0.261 6.0 mtt180 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.735 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.649 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.632 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.725 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.718 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.769 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.7 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.748 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.728 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.459 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.631 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.941 ' HB2' ' HD3' ' A' ' 39' ' ' ARG . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.9 m-20 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.93 HD21 HG22 ' A' ' 123' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.798 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.404 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.436 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.768 ' HG ' HG12 ' A' ' 100' ' ' VAL 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.579 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.579 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.768 HG12 ' HG ' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.457 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.877 HD21 HD12 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.428 ' H ' ' H ' ' A' ' 102' ' ' LEU . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.926 HD23 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.743 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.719 ' CE ' ' HB3' ' A' ' 115' ' ' HIS . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.719 ' HB3' ' CE ' ' A' ' 111' ' ' MET . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.926 HD21 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.602 ' NE2' HD23 ' A' ' 102' ' ' LEU . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.56 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.675 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.79 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.93 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.646 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.056 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.79 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.565 ' HD2' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.056 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.62 ' OE1' HD22 ' A' ' 94' ' ' LEU . 6.5 tp60 -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.826 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.463 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.758 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.597 ' H ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.468 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.724 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.3 10.7 t-20 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.852 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.772 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.852 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.805 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.016 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.016 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.596 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 37' ' ' PHE . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 . . . . . 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.797 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.599 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.428 ' NE2' HG12 ' A' ' 16' ' ' VAL . 11.1 m80 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.771 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.761 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.805 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.788 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.715 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.689 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.554 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.697 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 73' ' ' GLN . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.425 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.772 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 123' ' ' THR . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.851 HD12 HD13 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.955 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.489 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.747 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.955 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.752 HD21 ' OE1' ' A' ' 97' ' ' GLU . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.838 ' CD1' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.504 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.752 ' OE1' HD21 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.604 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.849 ' CG1' HD13 ' A' ' 102' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.734 ' OG1' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.849 HD13 ' CG1' ' A' ' 100' ' ' VAL . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.756 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.634 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.661 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.58 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.654 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.679 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.687 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.611 HG22 ' HA ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.613 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.966 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.687 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.634 ' HE2' ' CD1' ' A' ' 114' ' ' PHE . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.966 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.815 ' HG3' HD23 ' A' ' 94' ' ' LEU . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.597 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.8 m . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.053 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 12' ' ' ARG . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.053 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 12.0 t-20 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.771 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.757 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.787 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.037 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.037 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.536 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.747 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 . . . . . 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.699 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.499 ' HD2' ' HG2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.546 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.801 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.787 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.757 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.611 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.703 HD21 ' HG3' ' A' ' 68' ' ' PRO . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.712 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.499 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.543 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.712 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.771 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.004 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.1 m-20 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.004 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.058 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.919 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.893 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.814 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.893 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 93' ' ' LEU . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.814 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.832 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.841 ' C ' HD13 ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.735 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.832 ' CB ' HD23 ' A' ' 102' ' ' LEU . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.434 ' CE1' ' HE2' ' A' ' 129' ' ' LYS . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.735 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.585 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.919 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' THR . . . . . 1.058 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.777 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.595 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.979 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.719 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.467 ' NZ ' ' CD2' ' A' ' 117' ' ' HIS . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.979 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.652 ' HG3' HD22 ' A' ' 94' ' ' LEU . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.583 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.507 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.459 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.496 ' H ' HG22 ' A' ' 8' ' ' THR . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 16' ' ' VAL . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.069 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.963 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.069 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.521 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 22' ' ' ASN . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.401 ' HB3' ' OD1' ' A' ' 20' ' ' ASP 0.316 12.1 t-20 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.564 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.734 ' HB2' HD22 ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.964 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.964 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.667 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.585 HG22 ' N ' ' A' ' 37' ' ' PHE . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.773 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 . . . . . 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.681 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.963 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.463 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.938 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.68 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.782 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.726 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.717 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.606 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.741 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.812 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.812 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.449 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' CD ' ' A' ' 74' ' ' PRO . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.634 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.562 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.506 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.634 ' HB3' ' O ' ' A' ' 71' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' CG ' ' A' ' 80' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.681 ' HB2' ' NH2' ' A' ' 39' ' ' ARG . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.973 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 25.2 m-20 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.973 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.408 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.781 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.76 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.817 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.778 HD12 ' O ' ' A' ' 90' ' ' ALA 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.649 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.649 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.868 HD22 HD13 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.797 HG11 ' CE ' ' A' ' 111' ' ' MET . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.797 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.521 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.668 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.668 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 84' ' ' LEU . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.781 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.932 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.668 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.432 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.808 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.932 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.445 ' OE1' HD13 ' A' ' 94' ' ' LEU . 2.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.531 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.488 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.5 m . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.578 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.673 ' H ' HG22 ' A' ' 8' ' ' THR . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.982 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.3 tm0? -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.593 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.982 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 11.6 t-20 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.814 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.736 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.824 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.999 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.999 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.556 HG22 ' N ' ' A' ' 37' ' ' PHE . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 . . . . . 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.697 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.747 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.554 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.854 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.585 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.882 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.633 HG22 ' CD1' ' A' ' 29' ' ' PHE . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.824 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.736 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.805 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.733 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.013 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.013 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.733 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.012 HD21 ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.848 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.868 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.848 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 96' ' ' GLN . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.14 HD11 HD13 ' A' ' 102' ' ' LEU . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.66 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.667 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.667 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.621 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 94' ' ' LEU . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.14 HD13 HD11 ' A' ' 94' ' ' LEU . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.971 HD12 HD13 ' A' ' 116' ' ' LEU . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.715 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.524 ' HE2' ' HB3' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.915 ' HA ' HD23 ' A' ' 116' ' ' LEU . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.567 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 7.4 t-80 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.036 HD21 HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.638 ' ND1' ' HG3' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.716 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.903 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.678 ' HB ' HD13 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' THR . . . . . 1.012 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.016 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.903 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.638 ' HG3' ' ND1' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.016 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.562 ' HG2' HD23 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.715 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.453 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.66 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.449 ' O ' ' N ' ' A' ' 10' ' ' ASP . 20.6 m . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.623 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.628 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.876 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.022 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.628 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.876 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.022 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 12.4 t-20 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.783 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.537 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.799 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.76 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.848 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.581 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.916 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.916 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.536 HG22 ' N ' ' A' ' 37' ' ' PHE . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.726 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 . . . . . 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.783 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 . . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.746 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.646 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.458 ' NE2' HG12 ' A' ' 16' ' ' VAL . 9.9 m80 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.59 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.848 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.76 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.502 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.764 ' HB1' HE22 ' A' ' 73' ' ' GLN . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.592 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.708 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.633 ' HG3' HD21 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.764 HE22 ' HB1' ' A' ' 58' ' ' ALA . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.714 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.752 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.011 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 76.3 m-20 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.011 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.996 HD21 ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.854 ' HE3' HD13 ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.727 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.792 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.669 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.8 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.668 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.668 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.599 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.573 HG11 HD23 ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 102' ' ' LEU . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.854 HD13 ' HE3' ' A' ' 86' ' ' LYS . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.636 ' HB2' ' CD1' ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.784 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.477 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.429 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.831 ' HA ' HD11 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.476 ' HA ' ' CG ' ' A' ' 118' ' ' ARG . 13.0 t-80 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.657 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.582 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.666 HG22 HD22 ' A' ' 84' ' ' LEU . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.996 ' HA ' HD21 ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.787 HG22 ' HB3' ' A' ' 130' ' ' ALA . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.623 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.787 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.8 ' OE1' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.675 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.447 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.807 ' O ' HG23 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.026 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.026 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.701 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.8 t-20 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.691 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.799 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.691 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.738 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.82 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.992 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.992 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.539 HG22 ' N ' ' A' ' 37' ' ' PHE . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.75 ' HD2' ' HB2' ' A' ' 77' ' ' ALA 0.297 1.3 mtm180 . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.722 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.701 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.561 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.782 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.709 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.738 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.732 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.761 HD21 ' HG3' ' A' ' 68' ' ' PRO . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.529 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.529 ' HD3' ' NE ' ' A' ' 43' ' ' ARG 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.526 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 66.9 m-20 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.084 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.907 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 1.028 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.907 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.488 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.761 HD13 ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.028 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.772 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.761 ' OE1' HD13 ' A' ' 93' ' ' LEU . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.617 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.617 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.667 HG13 HD23 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.438 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.85 HD22 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.803 ' HE1' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.509 ' O ' ' HE3' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.539 ' HB3' ' HG3' ' A' ' 111' ' ' MET . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.85 HD11 HD22 ' A' ' 105' ' ' LEU . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.579 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.616 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.602 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.864 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' THR . . . . . 1.084 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.724 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.012 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.864 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.579 ' HD3' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.012 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.687 ' HG2' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.765 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.772 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.752 HG22 ' H ' ' A' ' 11' ' ' GLN . 63.5 m . . . . . 0 N--CA 1.469 0.482 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.752 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.647 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.6 t-20 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.825 ' C ' ' HB1' ' A' ' 77' ' ' ALA 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.815 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.533 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.814 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.085 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.085 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.559 HG22 ' N ' ' A' ' 37' ' ' PHE . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 . . . . . 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.772 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.455 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.679 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.451 ' NE2' HG12 ' A' ' 16' ' ' VAL . 11.7 m80 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.68 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.635 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.834 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.787 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.764 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.814 ' HB2' HG22 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.672 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.788 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.659 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.648 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.825 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 76.5 m-20 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.807 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.402 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.758 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.502 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.637 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.637 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.693 HD22 ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.894 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.737 ' HE3' HG11 ' A' ' 109' ' ' VAL . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.693 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.645 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.894 HD21 HD23 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.516 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.758 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.745 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 121' ' ' LYS . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.889 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.084 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.745 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.084 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.569 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m . . . . . 0 N--CA 1.464 0.237 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.49 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.927 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.062 ' NE1' HD11 ' A' ' 17' ' ' LEU . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.49 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.927 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.062 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 12.9 t-20 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.734 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.796 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.934 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.934 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.627 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.561 ' HB ' HG23 ' A' ' 34' ' ' THR . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 5.2 p90 . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.774 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.434 ' NE2' HG12 ' A' ' 16' ' ' VAL . 10.2 m80 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.796 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.492 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.708 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.665 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.8 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.501 ' C ' ' H ' ' A' ' 71' ' ' ARG . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.747 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.023 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.023 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.9 OUTLIER -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.429 ' HB2' ' HD3' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.965 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.998 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.965 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.8 HD23 ' OG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.998 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.663 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.663 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.792 ' CG1' HD12 ' A' ' 102' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.8 ' OG1' HD23 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.926 ' CD2' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.761 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.596 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.411 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.508 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.4 t-80 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 102' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.607 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.63 ' O ' HD23 ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.695 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.895 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 84' ' ' LEU . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.952 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.57 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.026 HG21 ' CE3' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.895 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.521 ' HE2' ' CE1' ' A' ' 117' ' ' HIS . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.495 ' HB3' HG23 ' A' ' 127' ' ' THR . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.026 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG3' HD22 ' A' ' 94' ' ' LEU . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.544 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.78 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.414 ' HA ' ' HG3' ' A' ' 95' ' ' GLU . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.737 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.6 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.508 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.737 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.709 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.521 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.448 ' C ' HD21 ' A' ' 78' ' ' ASN 0.305 11.7 t-20 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.762 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.846 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.762 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.806 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.018 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.018 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.628 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 37' ' ' PHE . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.756 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 2.8 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.818 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.49 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.437 ' NE2' HG12 ' A' ' 16' ' ' VAL . 12.6 m80 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.648 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.607 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.806 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.694 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.624 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.756 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.716 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.6 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.846 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.045 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.045 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 87' ' ' ILE . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.987 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.784 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.896 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.465 HD23 ' CB ' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.896 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.535 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.535 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.639 HG13 ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.536 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 101' ' ' THR . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 1.008 HD23 HD11 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.008 HD11 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 33.4 m80 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.645 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.943 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.987 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.821 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.643 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.075 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.943 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.075 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.627 ' HG3' HD22 ' A' ' 94' ' ' LEU . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.704 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.496 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ASP . 28.2 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.536 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.894 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.047 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.698 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 12.3 t-20 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.81 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.779 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.832 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.013 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.013 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.55 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.491 HG22 ' N ' ' A' ' 37' ' ' PHE . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.764 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 1.8 p90 . . . . . 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.914 ' HD2' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 1.047 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.698 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.812 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.889 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.423 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.586 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.524 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 30.9 m120 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.832 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.756 ' HB2' HG22 ' A' ' 28' ' ' VAL . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.613 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.764 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.798 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.798 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.454 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.595 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.451 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.914 ' HB2' ' HD2' ' A' ' 39' ' ' ARG . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.962 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 52.5 m-20 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.962 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 HG22 ' A' ' 123' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.797 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.733 HG23 ' CD1' ' A' ' 135' ' ' TRP . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.497 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.655 ' HB ' ' HD3' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.655 ' HD3' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.534 HG13 ' HA ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.653 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.949 HD23 HD11 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.781 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.651 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.431 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.431 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 12.6 t-80 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.949 HD11 HD23 ' A' ' 105' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.529 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.647 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.71 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.953 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.952 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.931 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.505 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.96 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.953 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.431 ' HZ3' ' CE1' ' A' ' 117' ' ' HIS . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.96 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.649 ' OE1' HD13 ' A' ' 94' ' ' LEU . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.733 ' CD1' HG23 ' A' ' 88' ' ' THR . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.497 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.432 ' HG2' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m . . . . . 0 N--CA 1.465 0.305 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.677 ' H ' HG22 ' A' ' 8' ' ' THR . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.786 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.751 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.751 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 13.2 t-20 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.621 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.766 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.624 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.935 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.935 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.615 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 . . . . . 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.786 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.598 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.677 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.632 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.611 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.825 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.68 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.766 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.615 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.751 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.653 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.46 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 62' ' ' LEU . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.671 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.773 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.028 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 70.0 m-20 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.028 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.506 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.009 HD21 HG22 ' A' ' 123' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.774 HG13 HD13 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.922 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 1.035 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.922 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.035 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HG2' ' OXT' ' A' ' 139' ' ' ARG . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.585 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.955 ' CG1' HD23 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.746 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.809 HD23 HD21 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.631 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.455 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.608 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.809 HD21 HD23 ' A' ' 105' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.502 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.672 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.876 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' THR . . . . . 1.009 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.803 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.597 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.597 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.018 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.876 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.502 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.018 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.857 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.857 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.469 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.6 m . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.918 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.071 ' NE1' HD11 ' A' ' 17' ' ' LEU . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.502 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.071 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.712 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 11.6 t-20 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.805 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.781 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.735 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.805 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.777 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.612 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.021 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.021 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.612 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.555 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.737 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.4 p90 . . . . . 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 . . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.698 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.442 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.546 ' NE2' HG12 ' A' ' 16' ' ' VAL . 10.3 m80 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.808 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.766 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.605 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.777 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.609 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.737 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.515 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.515 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.656 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.583 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NH1' ' HG3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.615 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.423 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.781 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.3 m-20 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.728 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.805 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.663 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.585 HD21 HG21 ' A' ' 101' ' ' THR . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.634 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.566 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.585 HG21 HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.853 HD21 ' NE2' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.814 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.827 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB2' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB2' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.827 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.427 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.62 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.814 HD21 HD23 ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.853 ' NE2' HD21 ' A' ' 102' ' ' LEU . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.805 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.819 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.77 HG22 ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.822 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.118 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.819 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.5 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.118 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.634 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.473 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.3 m . . . . . 0 CA--C 1.519 -0.241 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.566 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.558 ' H ' HG22 ' A' ' 8' ' ' THR . 0.6 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.96 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.066 ' NE1' HD11 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.477 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 12' ' ' ARG . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.066 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 11.0 t-20 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.653 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.768 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.781 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.066 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.066 HG22 HG12 ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.563 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.561 HG22 ' N ' ' A' ' 37' ' ' PHE . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.74 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.418 HH11 ' HG2' ' A' ' 71' ' ' ARG . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.683 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.551 ' NE2' HG12 ' A' ' 16' ' ' VAL . 9.4 m80 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.794 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.627 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.729 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.781 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.768 ' HB2' HG22 ' A' ' 28' ' ' VAL . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.607 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.705 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.749 HD21 ' HG3' ' A' ' 68' ' ' PRO . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.406 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.749 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.488 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.789 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.998 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.4 m-20 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.998 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.725 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.47 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.966 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.742 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.633 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.633 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.608 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.688 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.843 HD23 ' HB2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 1.032 HD23 HD13 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.797 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.797 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.745 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.843 ' HB2' HD23 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.414 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.032 HD13 HD23 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.824 ' NE2' HD21 ' A' ' 102' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 115' ' ' HIS . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.753 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.722 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.966 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.828 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.004 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.666 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.457 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.004 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 94' ' ' LEU . 1.7 tt0 -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.498 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.76 HG22 ' H ' ' A' ' 11' ' ' GLN . 62.8 m . . . . . 0 CA--C 1.519 -0.221 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.555 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.76 ' H ' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.654 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.05 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.748 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.05 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.581 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 11.8 t-20 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.69 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.627 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.79 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.56 ' HA ' ' O ' ' A' ' 36' ' ' ILE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.049 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.049 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.79 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.748 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.634 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 30.6 m120 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.769 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.602 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.74 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.745 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.416 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.745 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.567 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.47 ' O ' ' HD2' ' A' ' 74' ' ' PRO . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.507 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.791 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.992 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 70.4 m-20 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.992 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.791 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.0 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.775 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.775 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.677 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.511 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.836 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.49 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.614 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 98' ' ' THR . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.959 HD13 ' N ' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.959 ' N ' HD13 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.668 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.536 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.428 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.845 ' HB2' HD11 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.535 ' N ' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.56 ' O ' HD23 ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.771 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.755 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' THR . . . . . 1.0 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.905 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.755 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.722 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.836 ' CD ' HD22 ' A' ' 94' ' ' LEU . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.49 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.601 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.564 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 1.038 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.038 HG23 ' O ' ' A' ' 12' ' ' ARG . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.477 ' C ' HD21 ' A' ' 78' ' ' ASN 0.3 11.9 t-20 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.908 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.666 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.908 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.779 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.778 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.064 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.064 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.616 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 . . . . . 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.786 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.542 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.699 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.538 ' NE2' HG12 ' A' ' 16' ' ' VAL . 9.6 m80 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.865 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.633 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.809 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.778 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.779 ' HB2' HG22 ' A' ' 28' ' ' VAL . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.656 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.729 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.703 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.427 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.542 ' HG3' ' HD3' ' A' ' 43' ' ' ARG 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.668 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.733 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.035 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.035 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.766 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.655 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.803 HD22 ' NE2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.447 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.498 HD22 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.476 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.457 ' CD1' ' N ' ' A' ' 114' ' ' PHE . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.583 ' HB3' ' CG ' ' A' ' 111' ' ' MET . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 118' ' ' ARG . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.766 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.89 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.918 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.654 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.918 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.803 ' NE2' HD22 ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.3 m . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.489 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.644 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.819 ' O ' HG23 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.029 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.029 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 12.5 t-20 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.773 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.777 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.78 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.015 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.015 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.646 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.56 HG22 ' N ' ' A' ' 37' ' ' PHE . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 . . . . . 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.708 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 11.9 m80 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.653 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.679 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.78 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.679 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.714 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.467 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.691 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.777 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.017 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 67.2 m-20 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.017 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.917 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.776 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.765 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.765 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.54 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.677 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.677 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.73 HG13 ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.725 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.822 ' HG ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.606 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.508 ' HB3' HD13 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.617 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.822 HD13 ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.627 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.573 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.714 ' HD2' ' HA ' ' A' ' 126' ' ' MET 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.917 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.697 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.714 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.929 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.648 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.605 ' HE3' ' CE1' ' A' ' 117' ' ' HIS . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.5 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.929 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 6.1 tm0? -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.503 ' CD1' HG23 ' A' ' 88' ' ' THR 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.539 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 8' ' ' THR . 19.2 m . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.653 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.521 ' H ' HG22 ' A' ' 8' ' ' THR . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 1.049 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.049 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.688 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.467 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 20' ' ' ASP . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.476 ' C ' HD21 ' A' ' 78' ' ' ASN 0.303 11.5 t-20 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.991 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.978 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.842 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.991 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' ' 55' ' ' TYR . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.042 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.042 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 37' ' ' PHE . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.75 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 . . . . . 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.978 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.741 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.741 ' HB2' ' NH1' ' A' ' 43' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 11.3 m80 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.624 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.632 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.844 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.767 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.789 ' HB2' HG22 ' A' ' 28' ' ' VAL . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.427 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.75 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.774 HD21 ' HG3' ' A' ' 68' ' ' PRO . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.774 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.728 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.842 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.025 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 1.025 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.738 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.494 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.823 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.788 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.602 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.587 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.456 HD21 ' NE2' ' A' ' 117' ' ' HIS . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.617 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.769 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' MET . . . . . 0.532 ' SD ' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.45 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.45 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 118' ' ' ARG . 10.0 t-80 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.638 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 115' ' ' HIS . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.722 ' HG ' HG11 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.613 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.937 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.823 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.675 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.491 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' THR . . . . . 1.105 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' PRO . . . . . 0.937 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 1.105 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.792 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' TRP . . . . . 0.785 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.602 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.194 0.521 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 51.58 91.84 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.29 -0.882 . . . . 0.0 110.384 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -132.16 121.1 23.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 110.707 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.52 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -67.82 -154.56 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.468 -0.77 . . . . 0.0 108.931 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.563 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.7 m -65.7 44.24 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.263 -0.898 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.46 36.25 0.15 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.445 -0.785 . . . . 0.0 110.259 179.906 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER 179.78 64.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.265 -0.897 . . . . 0.0 111.502 -179.462 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.4 m -80.64 63.93 5.24 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.574 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.57 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.837 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.57 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 12' ' ' ARG . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 12.8 t-20 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.775 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.775 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.754 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.99 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.99 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.68 HG22 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.998 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -145.9 118.3 8.47 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.54 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.69 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 -87.86 173.71 6.08 Favored Pre-proline 0 C--N 1.287 -2.116 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.78 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.456 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.659 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.659 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.837 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 10.4 m80 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 48' ' ' LEU . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.617 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.775 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.744 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.606 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.749 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.55 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.629 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.732 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.732 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.718 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.51 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.632 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.9 m-20 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.724 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.875 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.997 HD23 ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.812 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 1.117 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.661 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.661 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.746 HG12 HD11 ' A' ' 102' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 1.117 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.78 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.78 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 109' ' ' VAL . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.498 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.619 ' CB ' HD22 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.563 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.902 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.485 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.433 HH12 ' H41' ' B' ' 203' ' ' ' DC' . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.603 HD12 ' HE1' ' A' ' 111' ' ' MET . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.875 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.771 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.875 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.925 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.771 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 1.085 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.545 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.925 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.812 ' OE1' HD22 ' A' ' 94' ' ' LEU . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.565 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.418 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.33 1 C3'-C2'-C1' 114.792 8.637 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.565 3 C3'-C2'-C1' 113.723 7.873 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.489 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.829 1 C3'-C2'-C1' 114.911 8.722 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.508 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.25 2 C3'-C2'-C1' 114.944 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.508 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.707 2 C3'-C2'-C1' 114.535 8.454 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.583 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.031 2 C3'-C2'-C1' 114.241 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.621 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.107 8.148 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.621 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.114 2 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.458 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.997 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 1 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.584 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.05 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.902 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.671 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.599 1 C3'-C2'-C1' 114.526 8.447 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.573 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.65 2 C3'-C2'-C1' 114.909 8.721 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.519 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 2 C3'-C2'-C1' 115.749 9.321 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.652 2 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.52 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.876 2 C3'-C2'-C1' 114.846 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.514 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.706 8.576 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.432 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.145 2 C3'-C2'-C1' 114.347 8.319 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.578 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.19 2 C3'-C2'-C1' 114.626 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.578 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.028 2 C3'-C2'-C1' 114.594 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 1.085 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.291 1 C3'-C2'-C1' 114.876 8.697 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.495 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.086 1 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.536 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.536 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.162 1 C3'-C2'-C1' 115.213 8.938 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.473 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.693 8.566 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.45 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.587 1 C3'-C2'-C1' 114.815 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.544 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.079 1 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.622 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.622 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.224 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.718 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.403 -11.537 1 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.998 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.589 2 C3'-C2'-C1' 114.884 8.703 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.842 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.713 2 C3'-C2'-C1' 115.522 9.158 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.474 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.173 2 C3'-C2'-C1' 114.804 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.411 -10.726 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.497 2 C3'-C2'-C1' 114.223 8.231 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.222 0.534 . . . . 0.0 110.138 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.62 121.89 46.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.0 110.046 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -151.34 99.61 2.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 110.31 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.37 -154.84 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.163 -0.96 . . . . 0.0 109.274 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 9.0 t -72.5 45.34 0.13 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 110.384 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.548 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.56 68.01 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -179.29 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.95 27.55 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.263 -0.898 . . . . 0.0 111.909 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.798 HG22 ' H ' ' A' ' 11' ' ' GLN . 72.1 m -80.04 64.41 4.86 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.786 -1.196 . . . . 0.0 107.928 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.575 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.798 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.061 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.515 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.061 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.2 t-20 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.858 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.679 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.858 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.727 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.827 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.692 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.067 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.067 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.645 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.592 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.755 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -147.12 116.77 7.1 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.486 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.62 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 -87.46 177.82 2.52 Favored Pre-proline 0 C--N 1.289 -2.039 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.122 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.785 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.722 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.876 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.939 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 10.9 m80 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.755 ' HA ' ' OP1' ' C' ' 235' ' ' ' DT' . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.79 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.681 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.827 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.727 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.612 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.681 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.522 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.706 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.736 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.97 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.0 m-20 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.97 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.985 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.709 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.87 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.87 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.585 HD23 ' OG1' ' A' ' 101' ' ' THR . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.678 ' HG ' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.466 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.541 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.767 HG12 ' CD1' ' A' ' 102' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.814 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.866 HD23 HD12 ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.744 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.543 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.543 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.557 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.775 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.866 HD12 HD23 ' A' ' 102' ' ' LEU . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.412 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.64 ' C ' HD13 ' A' ' 119' ' ' LEU . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.694 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.743 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.985 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.736 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.712 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.743 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 1.05 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.555 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.749 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.722 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.722 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.491 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.514 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.263 1 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.514 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.673 3 C3'-C2'-C1' 113.674 7.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.453 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.983 1 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.476 ' C2 ' ' C5 ' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.258 2 C3'-C2'-C1' 114.871 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.945 2 C3'-C2'-C1' 114.924 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.836 2 C3'-C2'-C1' 114.224 8.232 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.554 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.408 -10.974 1 C3'-C2'-C1' 114.388 8.349 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.544 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.059 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.546 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.57 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.735 1 C3'-C2'-C1' 115.162 8.901 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.599 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.262 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.775 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.408 -11.003 1 C3'-C2'-C1' 114.584 8.489 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.699 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.887 1 C3'-C2'-C1' 114.678 8.556 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.589 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.571 2 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.541 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.247 2 C3'-C2'-C1' 115.795 9.354 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.541 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.649 2 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.528 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.807 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.463 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.195 2 C3'-C2'-C1' 114.258 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.587 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.305 2 C3'-C2'-C1' 114.568 8.477 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.587 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.316 2 C3'-C2'-C1' 114.57 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 1.05 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.433 1 C3'-C2'-C1' 115.07 8.835 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.521 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.934 1 C3'-C2'-C1' 114.921 8.729 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.521 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.066 2 C3'-C2'-C1' 114.521 8.443 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.516 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.11 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.516 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.759 2 C3'-C2'-C1' 114.686 8.561 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.524 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.336 1 C3'-C2'-C1' 114.881 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.546 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.175 2 C3'-C2'-C1' 114.61 8.507 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.652 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.078 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.652 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.144 8.889 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.631 " H1'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.407 -11.079 1 C3'-C2'-C1' 114.9 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.876 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.413 -10.465 2 C3'-C2'-C1' 114.321 8.301 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.939 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.696 2 C3'-C2'-C1' 115.534 9.167 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.518 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.419 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.416 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.823 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.416 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.437 2 C3'-C2'-C1' 114.318 8.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.729 0.3 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -121.5 -25.33 5.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.855 -1.153 . . . . 0.0 110.822 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -167.45 133.63 2.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.995 -1.065 . . . . 0.0 110.488 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -82.17 -154.91 0.13 Allowed 'General case' 0 N--CA 1.484 1.229 0 O-C-N 121.203 -0.936 . . . . 0.0 108.78 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.723 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.8 m -73.58 41.25 0.11 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.103 . . . . 0.0 110.087 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 5' ' ' THR . 90.2 m 79.36 51.83 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 120.993 0.425 . . . . 0.0 110.216 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.589 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -148.17 0.4 0.61 Allowed 'General case' 0 C--N 1.308 -1.212 0 O-C-N 121.236 -0.915 . . . . 0.0 111.886 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.776 HG22 ' H ' ' A' ' 11' ' ' GLN . 94.0 m -81.67 67.89 7.81 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 120.872 -1.142 . . . . 0.0 108.101 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.776 ' H ' HG22 ' A' ' 8' ' ' THR . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.869 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.579 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.869 HG23 ' O ' ' A' ' 12' ' ' ARG . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.649 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 11.6 t-20 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.851 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.762 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' ' HB3' ' A' ' 6' ' ' CYS . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.824 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.769 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.81 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.983 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.983 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.775 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.016 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.76 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 -144.31 117.33 8.86 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.496 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.941 ' HD3' ' HB2' ' A' ' 77' ' ' ALA 0.261 6.0 mtt180 -88.8 176.85 2.91 Favored Pre-proline 0 C--N 1.284 -2.274 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.086 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.735 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.649 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.485 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.688 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.632 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.808 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.1 m80 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.725 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.718 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.769 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.7 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.748 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.728 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.798 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.554 ' HB3' H5'' ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.459 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.631 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.941 ' HB2' ' HD3' ' A' ' 39' ' ' ARG . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.9 m-20 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.93 HD21 HG22 ' A' ' 123' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.798 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.404 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.436 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.768 ' HG ' HG12 ' A' ' 100' ' ' VAL 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.579 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.579 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.768 HG12 ' HG ' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.457 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.877 HD21 HD12 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.428 ' H ' ' H ' ' A' ' 102' ' ' LEU . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.926 HD23 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.743 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.719 ' CE ' ' HB3' ' A' ' 115' ' ' HIS . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.569 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.868 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.926 HD21 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.602 ' NE2' HD23 ' A' ' 102' ' ' LEU . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.56 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.675 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.79 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.93 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.646 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.056 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.79 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.732 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.529 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.056 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.62 ' OE1' HD22 ' A' ' 94' ' ' LEU . 6.5 tp60 -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.826 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.463 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.531 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.218 1 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.635 2 C3'-C2'-C1' 113.701 7.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.462 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.808 1 C3'-C2'-C1' 114.928 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.522 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 2 C3'-C2'-C1' 114.983 8.774 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.522 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.632 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.42 -9.813 2 C3'-C2'-C1' 114.263 8.26 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.632 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.412 -10.645 2 C3'-C2'-C1' 114.168 8.191 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.616 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.688 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.914 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.611 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.408 -11.04 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.611 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.245 2 C3'-C2'-C1' 114.696 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.868 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.774 1 C3'-C2'-C1' 114.845 8.675 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.719 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.622 1 C3'-C2'-C1' 114.548 8.463 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.563 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.83 2 C3'-C2'-C1' 114.953 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.568 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 115.626 9.233 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.568 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.71 2 C3'-C2'-C1' 114.896 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.506 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.93 2 C3'-C2'-C1' 114.899 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.506 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.428 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.074 2 C3'-C2'-C1' 114.357 8.327 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.702 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.184 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.702 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.545 8.461 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.732 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -9.996 2 C3'-C2'-C1' 114.941 8.743 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.591 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.953 1 C3'-C2'-C1' 115.134 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.054 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.499 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.326 1 C3'-C2'-C1' 115.184 8.917 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.499 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.904 2 C3'-C2'-C1' 114.739 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.547 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.592 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.073 1 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.63 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.214 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.63 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.154 2 C3'-C2'-C1' 115.148 8.891 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.798 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 1.016 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.408 -11.01 2 C3'-C2'-C1' 114.648 8.534 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.815 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.508 2 C3'-C2'-C1' 115.575 9.197 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.447 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.482 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.422 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.733 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.422 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.302 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 mtm . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 132.27 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.105 -0.997 . . . . 0.0 111.165 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.99 -129.98 0.29 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -107.04 -154.34 0.52 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.521 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 t -63.67 22.84 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.843 -1.161 . . . . 0.0 108.938 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.747 ' H ' ' C ' ' A' ' 4' ' ' ALA . 1.1 t 79.74 -154.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -178.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.741 ' HG ' ' C ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER 68.46 -14.98 0.24 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.099 -1.001 . . . . 0.0 111.395 178.313 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.758 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m -79.84 63.6 4.44 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.817 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.597 ' H ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.468 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.724 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.3 10.7 t-20 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.852 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.772 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.852 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.805 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.016 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.016 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.596 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 37' ' ' PHE . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 -148.23 118.12 7.16 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.483 ' SG ' ' CB ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 -84.54 172.43 9.03 Favored Pre-proline 0 C--N 1.279 -2.481 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 177.4 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.797 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.417 ' HD3' " H4'" ' B' ' 199' ' ' ' DA' . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.751 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.639 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.811 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.1 m80 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.771 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.761 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.805 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.788 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.715 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.689 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.554 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.697 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.738 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.534 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.772 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 123' ' ' THR . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.851 HD12 HD13 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.955 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.489 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.747 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.955 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.752 HD21 ' OE1' ' A' ' 97' ' ' GLU . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.838 ' CD1' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.504 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.752 ' OE1' HD21 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.604 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.849 ' CG1' HD13 ' A' ' 102' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.734 ' OG1' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.849 HD13 ' CG1' ' A' ' 100' ' ' VAL . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.756 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.634 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.785 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.661 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.58 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.654 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.679 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.687 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.611 HG22 ' HA ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.613 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.966 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.687 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.993 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.596 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.966 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.815 ' HG3' HD23 ' A' ' 94' ' ' LEU . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.597 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.56 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -11.037 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.56 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 3 C3'-C2'-C1' 113.638 7.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.485 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 115.049 8.821 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.992 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.542 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.64 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.571 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.081 2 C3'-C2'-C1' 114.147 8.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.613 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.412 -10.621 1 C3'-C2'-C1' 114.2 8.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.613 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.996 8.783 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.487 ' C6 ' ' C6 ' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.769 8.621 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.589 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.589 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.903 2 C3'-C2'-C1' 114.715 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.785 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.447 8.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.643 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.801 1 C3'-C2'-C1' 114.588 8.492 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.588 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.582 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.496 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.086 2 C3'-C2'-C1' 115.712 9.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.496 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.569 2 C3'-C2'-C1' 114.914 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.5 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.82 2 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.5 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.407 -11.144 2 C3'-C2'-C1' 114.194 8.21 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.546 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.652 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.993 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.29 1 C3'-C2'-C1' 114.902 8.716 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.464 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.979 1 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.488 ' N4 ' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 114.431 8.379 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.489 ' N2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.463 2 C3'-C2'-C1' 115.141 8.886 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.449 ' H6 ' " H2'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.42 -9.786 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.471 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.374 1 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.648 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.969 2 C3'-C2'-C1' 114.742 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 115.086 8.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.751 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.404 -11.359 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.811 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.776 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 115.474 9.124 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.454 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.356 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.41 -10.809 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.459 2 C3'-C2'-C1' 114.292 8.28 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.194 0.521 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 53.39 92.9 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.412 -0.805 . . . . 0.0 110.547 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.93 145.43 33.03 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.402 -0.811 . . . . 0.0 110.306 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.566 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -65.78 -154.56 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.253 -0.905 . . . . 0.0 109.083 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 5' ' ' THR . 1.2 t -67.94 34.09 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.262 -0.899 . . . . 0.0 110.616 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.566 ' H ' ' C ' ' A' ' 4' ' ' ALA . 0.9 OUTLIER 79.84 53.06 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.59 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -171.61 35.58 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.326 -0.859 . . . . 0.0 111.672 -179.559 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.8 m -83.57 63.76 7.56 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.053 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 12' ' ' ARG . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.053 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 12.0 t-20 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.771 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.757 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.787 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.037 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.037 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.935 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.747 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 -147.09 118.92 8.09 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.593 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 -84.47 168.85 18.9 Favored Pre-proline 0 C--N 1.284 -2.241 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.487 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.699 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.557 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.689 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 10.9 m80 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.625 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.801 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.787 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.757 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.611 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.703 HD21 ' HG3' ' A' ' 68' ' ' PRO . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.712 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.758 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.499 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.543 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.712 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.771 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.004 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 69.1 m-20 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.004 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.058 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.919 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.893 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.814 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.893 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 93' ' ' LEU . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.814 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.832 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.841 ' C ' HD13 ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.735 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.832 ' CB ' HD23 ' A' ' 102' ' ' LEU . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.798 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.585 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.428 ' NH2' ' N7 ' ' C' ' 225' ' ' ' DG' . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.919 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . 1.058 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.777 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.595 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.979 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.719 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.846 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.986 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.979 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.652 ' HG3' HD22 ' A' ' 94' ' ' LEU . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.583 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.507 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.459 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.555 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.383 1 C3'-C2'-C1' 114.781 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.555 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.751 3 C3'-C2'-C1' 113.632 7.808 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.475 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.79 2 C3'-C2'-C1' 114.935 8.739 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.545 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 115.097 8.855 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.545 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.992 2 C3'-C2'-C1' 114.798 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.538 " O5'" H2'' ' B' ' 194' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.42 -9.764 2 C3'-C2'-C1' 114.182 8.201 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.605 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.153 8.18 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.605 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.424 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.901 2 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.633 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.727 1 C3'-C2'-C1' 115.307 9.005 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.633 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.708 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.798 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.52 1 C3'-C2'-C1' 114.763 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.647 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.893 1 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.584 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.572 2 C3'-C2'-C1' 114.767 8.619 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.493 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.6 9.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.06 8.828 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.549 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.893 2 C3'-C2'-C1' 114.772 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.549 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.315 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.442 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.183 2 C3'-C2'-C1' 114.308 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.586 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.096 2 C3'-C2'-C1' 114.608 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.647 " H3'" ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.986 ' OP1' ' HB2' ' A' ' 130' ' ' ALA . . . . . . . . 2 C3'--C2' 1.419 -9.876 1 C3'-C2'-C1' 114.892 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.949 1 C3'-C2'-C1' 114.974 8.767 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.628 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.874 2 C3'-C2'-C1' 114.506 8.433 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.628 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.262 1 C3'-C2'-C1' 115.084 8.846 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.474 ' C4 ' ' C8 ' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.951 2 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.454 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.389 1 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.64 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.64 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.408 -11.021 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.609 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.218 2 C3'-C2'-C1' 115.202 8.93 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.758 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.405 -11.273 1 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.935 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.793 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 115.546 9.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.455 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.413 2 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.405 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.84 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.404 2 C3'-C2'-C1' 114.28 8.272 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.055 0.455 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB3' HG21 ' A' ' 8' ' ' THR . 11.7 mtmm 52.11 94.28 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.399 -0.813 . . . . 0.0 110.601 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -167.08 70.43 0.1 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.128 -0.982 . . . . 0.0 110.742 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.484 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -78.88 -154.7 0.08 Allowed 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.195 -0.941 . . . . 0.0 108.682 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.576 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.3 m -70.62 38.37 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 O-C-N 120.998 -1.064 . . . . 0.0 110.18 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.582 ' O ' HD22 ' A' ' 7' ' ' LEU . 37.7 m 79.41 61.98 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.736 -0.602 . . . . 0.0 109.547 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.582 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -157.9 28.95 0.26 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 121.317 -0.864 . . . . 0.0 111.962 -179.125 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.596 HG21 ' HB3' ' A' ' 2' ' ' LYS . 21.0 m -79.97 64.36 4.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 107.993 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.496 ' H ' HG22 ' A' ' 8' ' ' THR . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 16' ' ' VAL . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.069 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.963 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.069 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.521 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 22' ' ' ASN . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.401 ' HB3' ' OD1' ' A' ' 20' ' ' ASP 0.316 12.1 t-20 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.564 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.734 ' HB2' HD22 ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.964 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.964 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.667 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.721 HD13 ' OP2' ' C' ' 234' ' ' ' DT' . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.773 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 -145.72 114.84 7.02 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.429 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.681 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.49 176.73 2.31 Favored Pre-proline 0 C--N 1.284 -2.248 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.963 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.493 ' CB ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.825 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.987 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 10.1 m80 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.938 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.68 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.782 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.726 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.717 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.606 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.741 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.812 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.812 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.449 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.619 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.88 ' HB2' " C5'" ' C' ' 233' ' ' ' DA' . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.562 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.506 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.634 ' HB3' ' O ' ' A' ' 71' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' CG ' ' A' ' 80' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.681 ' HB2' ' NH2' ' A' ' 39' ' ' ARG . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.973 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 25.2 m-20 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.973 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.408 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.781 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.76 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.817 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.778 HD12 ' O ' ' A' ' 90' ' ' ALA 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.649 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.649 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.868 HD22 HD13 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.797 HG11 ' CE ' ' A' ' 111' ' ' MET . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.797 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.618 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.686 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.544 HH12 ' N4 ' ' C' ' 226' ' ' ' DC' . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.668 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.668 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 84' ' ' LEU . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.781 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.932 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.668 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.855 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.808 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.932 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.445 ' OE1' HD13 ' A' ' 94' ' ' LEU . 2.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.531 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.488 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.502 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.347 1 C3'-C2'-C1' 114.68 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.553 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.712 3 C3'-C2'-C1' 113.74 7.885 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.553 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 115.127 8.877 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.448 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.16 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.448 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.621 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.197 2 C3'-C2'-C1' 114.205 8.218 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.621 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.839 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.587 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.96 2 C3'-C2'-C1' 114.933 8.738 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.493 " H4'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.605 8.504 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.592 1 C3'-C2'-C1' 115.039 8.814 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.505 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 1 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.686 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.585 1 C3'-C2'-C1' 114.492 8.423 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.672 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.616 1 C3'-C2'-C1' 114.571 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.571 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.798 2 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.508 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.222 2 C3'-C2'-C1' 115.789 9.35 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.508 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.832 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.545 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.787 2 C3'-C2'-C1' 114.714 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.545 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.403 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.403 -11.456 2 C3'-C2'-C1' 114.273 8.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.566 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.54 8.457 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.618 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.419 -9.908 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.855 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.426 1 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.515 ' C6 ' ' NH1' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.763 1 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.544 ' N4 ' HH12 ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.069 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.53 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.874 1 C3'-C2'-C1' 115.285 8.989 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.45 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.762 2 C3'-C2'-C1' 114.745 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.487 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.447 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.559 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.023 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.639 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.951 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.674 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.844 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.88 " C5'" ' HB2' ' A' ' 71' ' ' ARG . . . . . . . . 2 C3'--C2' 1.401 -11.674 2 C3'-C2'-C1' 114.072 8.123 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.825 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.412 -10.647 2 C3'-C2'-C1' 114.6 8.5 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.987 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.692 2 C3'-C2'-C1' 115.661 9.258 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.441 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.42 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.503 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.389 2 C3'-C2'-C1' 114.278 8.27 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.093 0.473 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 1.0 OUTLIER 65.15 -137.43 0.22 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.41 -0.806 . . . . 0.0 110.598 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.58 ' HB3' HG21 ' A' ' 8' ' ' THR . 70.6 mttt 63.87 149.0 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.05 -1.031 . . . . 0.0 109.829 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -98.66 165.87 11.6 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.134 -0.979 . . . . 0.0 111.614 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.638 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 p -66.12 77.69 0.09 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.506 0.67 . . . . 0.0 109.396 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.638 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.8 t 89.37 -178.27 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.808 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.8 OUTLIER 54.53 24.59 5.46 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.919 -1.113 . . . . 0.0 109.463 -179.363 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.5 m -99.67 64.33 1.28 Allowed 'General case' 0 C--N 1.296 -1.737 0 C-N-CA 119.739 -0.784 . . . . 0.0 109.403 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.578 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.673 ' H ' HG22 ' A' ' 8' ' ' THR . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.982 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.3 tm0? -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.593 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.982 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 11.6 t-20 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.814 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.736 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.824 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.999 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.999 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.586 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.868 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 -146.73 119.2 8.45 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.524 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 -82.58 164.47 47.11 Favored Pre-proline 0 C--N 1.286 -2.192 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.057 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.697 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.747 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.554 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.618 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.854 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.617 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.585 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.882 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.633 HG22 ' CD1' ' A' ' 29' ' ' PHE . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.824 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.736 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.805 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.942 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.733 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.013 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.013 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.733 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.012 HD21 ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.848 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.868 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.848 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 96' ' ' GLN . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.14 HD11 HD13 ' A' ' 102' ' ' LEU . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.66 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.667 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.667 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.621 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 94' ' ' LEU . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.14 HD13 HD11 ' A' ' 94' ' ' LEU . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.971 HD12 HD13 ' A' ' 116' ' ' LEU . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.715 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.539 ' HE2' ' HB3' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.915 ' HA ' HD23 ' A' ' 116' ' ' LEU . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.567 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.714 ' CE1' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.036 HD21 HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.638 ' ND1' ' HG3' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.716 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.903 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.678 ' HB ' HD13 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' THR . . . . . 1.012 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.016 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.903 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.758 ' HD2' ' H71' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.891 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.016 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.562 ' HG2' HD23 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.432 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.715 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.453 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.66 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.393 1 C3'-C2'-C1' 114.849 8.678 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.536 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.607 3 C3'-C2'-C1' 113.686 7.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.536 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 115.262 8.973 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.567 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.455 1 C3'-C2'-C1' 115.072 8.837 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.567 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.487 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.113 2 C3'-C2'-C1' 114.191 8.208 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.617 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.965 1 C3'-C2'-C1' 114.17 8.193 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.617 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.914 8.724 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.491 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.017 2 C3'-C2'-C1' 114.749 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.602 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.929 1 C3'-C2'-C1' 115.34 9.029 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.669 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.116 2 C3'-C2'-C1' 114.734 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.753 " O5'" ' H6 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 4 C3'--C2' 1.406 -11.223 1 C3'-C2'-C1' 114.516 8.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.683 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.993 1 C3'-C2'-C1' 114.468 8.406 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.608 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.531 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.513 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.552 2 C3'-C2'-C1' 115.658 9.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.513 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.842 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.77 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.325 2 C3'-C2'-C1' 114.806 8.647 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.438 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.403 -11.453 2 C3'-C2'-C1' 114.33 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.543 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.543 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.21 2 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.891 ' OP1' ' HA ' ' A' ' 130' ' ' ALA . . . . . . . . 2 C3'--C2' 1.421 -9.692 2 C3'-C2'-C1' 115.035 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.953 2 C3'-C2'-C1' 114.927 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.675 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.523 8.445 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.543 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.099 1 C3'-C2'-C1' 115.214 8.939 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.529 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.718 2 C3'-C2'-C1' 114.717 8.583 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.493 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.344 1 C3'-C2'-C1' 114.848 8.677 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.576 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.068 1 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.686 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.987 2 C3'-C2'-C1' 114.93 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.686 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.078 8.841 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.942 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.409 -10.939 1 C3'-C2'-C1' 114.703 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.868 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.407 -11.127 2 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.85 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.581 9.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.463 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.304 2 C3'-C2'-C1' 114.805 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.867 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.295 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.201 0.525 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -114.52 -22.36 9.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.346 -0.846 . . . . 0.0 110.415 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.28 159.35 1.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.154 -0.966 . . . . 0.0 109.776 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 1.04 ' HB3' ' OG1' ' A' ' 8' ' ' THR . . . -122.48 -154.4 0.6 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.088 -1.007 . . . . 0.0 110.594 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.562 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -60.61 25.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.423 -0.798 . . . . 0.0 112.731 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.562 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.6 OUTLIER 79.63 120.8 0.05 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.188 -0.945 . . . . 0.0 110.402 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.776 ' N ' HD22 ' A' ' 7' ' ' LEU . 2.8 mm? 59.81 63.82 1.41 Allowed 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 122.981 1.372 . . . . 0.0 110.203 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 1.04 ' OG1' ' HB3' ' A' ' 4' ' ' ALA . 20.6 m -86.91 66.31 9.37 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 113.847 -1.524 . . . . 0.0 107.99 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.623 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.628 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.876 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.022 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.628 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.876 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.022 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 12.4 t-20 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.783 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.537 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.799 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.76 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.848 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.581 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.916 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.916 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.015 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.726 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 -143.1 118.17 10.08 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.512 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.783 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER -82.0 164.69 47.29 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.03 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.746 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.457 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.67 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.66 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.848 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 9.9 m80 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.626 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.848 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.76 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.502 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.764 ' HB1' HE22 ' A' ' 73' ' ' GLN . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.592 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.708 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.633 ' HG3' HD21 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.782 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.764 HE22 ' HB1' ' A' ' 58' ' ' ALA . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.714 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.752 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.011 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 76.3 m-20 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.011 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.996 HD21 ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.854 ' HE3' HD13 ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.727 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.792 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.669 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.8 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.668 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.668 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.599 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.573 HG11 HD23 ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 102' ' ' LEU . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.854 HD13 ' HE3' ' A' ' 86' ' ' LYS . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.636 ' HB2' ' CD1' ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.784 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.477 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.429 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.831 ' HA ' HD11 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.584 ' CE2' ' H72' ' C' ' 223' ' ' ' DT' . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.924 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.657 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.582 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.666 HG22 HD22 ' A' ' 84' ' ' LEU . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.996 ' HA ' HD21 ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.787 HG22 ' HB3' ' A' ' 130' ' ' ALA . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.623 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.95 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.83 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.8 ' OE1' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.53 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.366 1 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.53 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.611 2 C3'-C2'-C1' 113.622 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.523 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.534 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.251 1 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.534 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.566 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.51 " H2'" ' H71' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.173 8.195 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.593 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.973 1 C3'-C2'-C1' 114.171 8.194 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.593 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.103 2 C3'-C2'-C1' 114.917 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.445 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.083 2 C3'-C2'-C1' 114.695 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.572 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.117 8.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.572 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.752 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.924 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.406 -11.206 1 C3'-C2'-C1' 114.542 8.459 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.667 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.572 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.644 2 C3'-C2'-C1' 114.807 8.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.578 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.138 2 C3'-C2'-C1' 115.718 9.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.578 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.722 8.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.756 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.405 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.178 2 C3'-C2'-C1' 114.344 8.317 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.587 " H2'" ' H71' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.089 2 C3'-C2'-C1' 114.488 8.42 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.587 ' H71' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.95 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.327 1 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.539 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.237 1 C3'-C2'-C1' 115.075 8.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.539 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.954 1 C3'-C2'-C1' 114.437 8.384 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.507 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.109 1 C3'-C2'-C1' 115.31 9.007 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.507 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.675 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.475 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.554 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.535 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.863 1 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.623 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.88 2 C3'-C2'-C1' 114.831 8.665 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.623 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.328 2 C3'-C2'-C1' 114.899 8.713 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.782 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.408 -11.046 2 C3'-C2'-C1' 114.559 8.471 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 1.015 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.698 2 C3'-C2'-C1' 114.683 8.559 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.717 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.552 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.695 2 C3'-C2'-C1' 114.508 8.434 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.398 2 C3'-C2'-C1' 114.329 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 tpt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.209 0.528 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 53.66 95.96 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.407 -0.808 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -107.58 155.21 20.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.344 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.14 -162.19 0.07 Allowed 'General case' 0 N--CA 1.485 1.325 0 O-C-N 121.203 -0.935 . . . . 0.0 109.603 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.521 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -72.28 50.83 0.23 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.191 -0.943 . . . . 0.0 110.714 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 5' ' ' THR . 21.2 m 79.41 71.73 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 175.57 37.85 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.368 -0.832 . . . . 0.0 110.457 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.675 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m -79.83 63.82 4.49 Favored 'General case' 0 C--N 1.296 -1.724 0 C-N-CA 118.876 -1.13 . . . . 0.0 109.082 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.447 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.807 ' O ' HG23 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.026 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.026 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.701 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.8 t-20 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.691 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.799 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.691 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.738 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.82 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.992 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.992 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.985 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 -145.66 118.07 8.49 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.53 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.75 ' HD2' ' HB2' ' A' ' 77' ' ' ALA 0.297 1.3 mtm180 -85.0 177.94 2.66 Favored Pre-proline 0 C--N 1.284 -2.276 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 177.894 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.722 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.701 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.485 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.561 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.648 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.685 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.7 m80 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.782 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.709 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.738 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.732 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.761 HD21 ' HG3' ' A' ' 68' ' ' PRO . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.809 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.568 ' NH2' ' O2 ' ' C' ' 231' ' ' ' DT' 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.526 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 66.9 m-20 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.084 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.907 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 1.028 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.907 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.488 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.761 HD13 ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.028 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.772 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.761 ' OE1' HD13 ' A' ' 93' ' ' LEU . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.617 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.617 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.667 HG13 HD23 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.438 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.85 HD22 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.803 ' HE1' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.509 ' O ' ' HE3' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.78 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.85 HD11 HD22 ' A' ' 105' ' ' LEU . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.579 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.616 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.602 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.864 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . 1.084 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.724 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.012 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.864 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.99 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.807 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.012 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.687 ' HG2' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.765 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.772 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.161 1 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.517 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.584 3 C3'-C2'-C1' 113.67 7.836 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.508 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.322 2 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 1 C3'-C2'-C1' 115.138 8.884 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.584 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.559 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.6 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.09 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.411 -10.742 2 C3'-C2'-C1' 114.183 8.202 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.461 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.133 2 C3'-C2'-C1' 114.802 8.644 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.599 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.755 1 C3'-C2'-C1' 115.209 8.935 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.599 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.955 2 C3'-C2'-C1' 114.642 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.78 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.561 1 C3'-C2'-C1' 114.639 8.528 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.667 1 C3'-C2'-C1' 114.402 8.359 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.581 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.744 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.498 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.36 2 C3'-C2'-C1' 115.623 9.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.498 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.896 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.7 2 C3'-C2'-C1' 114.645 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.495 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.235 2 C3'-C2'-C1' 114.461 8.4 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.612 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.314 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.682 " H3'" ' HG2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.42 -9.756 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.99 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.367 1 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.421 -9.745 1 C3'-C2'-C1' 114.835 8.668 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.588 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.073 2 C3'-C2'-C1' 114.596 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.575 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.951 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.493 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.841 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.473 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.508 1 C3'-C2'-C1' 114.892 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.549 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.999 1 C3'-C2'-C1' 114.816 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.613 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.874 2 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.613 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.205 2 C3'-C2'-C1' 114.976 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.809 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.423 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.985 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.834 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.854 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.69 1 C3'-C2'-C1' 115.539 9.171 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.466 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.38 2 C3'-C2'-C1' 114.834 8.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.406 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.412 -10.639 2 C3'-C2'-C1' 114.609 8.506 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.406 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.351 2 C3'-C2'-C1' 114.259 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.415 ' O ' ' N ' ' A' ' 3' ' ' LYS . 3.4 mtm . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.178 0.513 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.65 -72.44 0.06 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.51 -0.743 . . . . 0.0 110.658 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 1' ' ' MET . 7.6 mtmt -157.29 114.87 3.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.967 -1.083 . . . . 0.0 110.645 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.67 -154.89 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.262 -0.899 . . . . 0.0 109.105 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.575 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 m -70.33 41.47 0.05 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.104 -0.997 . . . . 0.0 110.876 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 5' ' ' THR . 33.1 m 79.35 53.81 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.786 -0.571 . . . . 0.0 109.951 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.569 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -147.47 1.19 0.71 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.354 -0.841 . . . . 0.0 111.954 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.752 HG22 ' H ' ' A' ' 11' ' ' GLN . 63.5 m -80.23 64.5 5.07 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 120.597 -1.315 . . . . 0.0 108.613 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.752 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.647 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 12.6 t-20 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.825 ' C ' ' HB1' ' A' ' 77' ' ' ALA 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.815 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.533 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.814 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.085 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.085 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.908 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 -147.58 116.46 6.79 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.495 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.772 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.1 178.23 1.7 Allowed Pre-proline 0 C--N 1.289 -2.063 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.553 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.681 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.679 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.887 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.7 m80 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.68 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.635 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.834 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.787 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.764 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.814 ' HB2' HG22 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.672 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.788 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.659 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.648 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.825 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 76.5 m-20 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.807 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.402 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.758 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.502 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.637 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.637 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.693 HD22 ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.894 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.737 ' HE3' HG11 ' A' ' 109' ' ' VAL . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.693 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.601 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.88 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.894 HD21 HD23 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.516 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.758 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.745 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 121' ' ' LYS . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.889 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.084 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.745 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.881 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.716 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.084 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.569 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.567 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.287 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.567 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.675 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.918 1 C3'-C2'-C1' 115.032 8.809 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.577 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.087 1 C3'-C2'-C1' 115.1 8.857 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.735 2 C3'-C2'-C1' 114.636 8.525 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.532 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.954 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.581 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.824 2 C3'-C2'-C1' 114.049 8.106 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.581 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.474 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.624 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.94 1 C3'-C2'-C1' 115.251 8.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.624 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.672 8.551 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.88 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.414 -10.392 1 C3'-C2'-C1' 114.819 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.612 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.57 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.718 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.254 2 C3'-C2'-C1' 115.683 9.274 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.584 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.516 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.822 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.516 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.51 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.344 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.63 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.452 2 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.63 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.202 1 C3'-C2'-C1' 114.628 8.52 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.881 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.413 -10.487 1 C3'-C2'-C1' 114.889 8.707 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.437 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.09 1 C3'-C2'-C1' 114.993 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.61 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.835 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.61 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.413 -10.499 2 C3'-C2'-C1' 115.013 8.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.433 ' H6 ' " H2'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.913 2 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.464 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.377 1 C3'-C2'-C1' 114.856 8.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.67 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 1 C3'-C2'-C1' 114.811 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.67 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.851 2 C3'-C2'-C1' 114.861 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.611 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.681 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.403 -11.465 1 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.908 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.414 -10.408 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.79 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.624 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.516 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.741 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.409 -10.922 2 C3'-C2'-C1' 114.585 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.431 2 C3'-C2'-C1' 114.299 8.285 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.234 0.54 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HB3' HG23 ' A' ' 8' ' ' THR . 31.6 mmtp -98.44 115.68 29.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.328 -0.857 . . . . 0.0 109.926 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -141.29 82.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.297 -0.877 . . . . 0.0 110.631 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.471 ' HB1' HD12 ' A' ' 7' ' ' LEU . . . -125.23 -154.94 0.65 Allowed 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.223 -0.923 . . . . 0.0 110.09 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.559 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -134.2 87.0 2.32 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.327 -0.858 . . . . 0.0 109.423 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.9 OUTLIER 79.63 24.93 0.42 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.451 0.643 . . . . 0.0 109.468 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.471 HD12 ' HB1' ' A' ' 4' ' ' ALA . 30.7 mt -119.71 -24.29 6.24 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.63 -0.669 . . . . 0.0 110.026 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.561 HG23 ' HB3' ' A' ' 2' ' ' LYS . 21.1 m -79.78 64.57 4.68 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.927 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.062 ' NE1' HD11 ' A' ' 17' ' ' LEU . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.49 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.927 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.062 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 12.9 t-20 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.734 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.796 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.934 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.934 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.627 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.87 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 5.2 p90 -145.7 116.59 7.76 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.469 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 -89.21 178.18 2.14 Favored Pre-proline 0 C--N 1.279 -2.48 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.001 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.774 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.436 ' NH2' ' N3 ' ' B' ' 197' ' ' ' DA' . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.817 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 10.2 m80 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.796 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.492 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.708 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.665 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.8 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.851 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.618 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.747 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.023 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.023 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.9 OUTLIER -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.429 ' HB2' ' HD3' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.965 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.998 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.965 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.8 HD23 ' OG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.998 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.663 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.663 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.792 ' CG1' HD12 ' A' ' 102' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.8 ' OG1' HD23 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.926 ' CD2' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.761 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.596 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.411 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.864 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 102' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.607 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.63 ' O ' HD23 ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.695 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.895 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 84' ' ' LEU . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.952 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.57 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.026 HG21 ' CE3' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.895 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 1.126 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.599 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.026 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG3' HD22 ' A' ' 94' ' ' LEU . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.544 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.78 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.414 ' HA ' ' HG3' ' A' ' 95' ' ' GLU . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.329 1 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.652 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.454 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.13 1 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.544 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.556 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.817 2 C3'-C2'-C1' 114.57 8.478 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.564 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.047 2 C3'-C2'-C1' 114.236 8.24 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.603 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.803 2 C3'-C2'-C1' 114.195 8.211 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.603 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.452 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.152 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.608 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.812 1 C3'-C2'-C1' 115.291 8.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.608 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.353 2 C3'-C2'-C1' 114.654 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.864 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.408 -11.024 1 C3'-C2'-C1' 114.632 8.523 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.659 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.75 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.586 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.646 2 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.497 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.171 2 C3'-C2'-C1' 115.653 9.252 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.497 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.678 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.514 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.822 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.514 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.27 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.558 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.968 2 C3'-C2'-C1' 114.501 8.429 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.558 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.959 1 C3'-C2'-C1' 114.595 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.507 ' P ' ' NZ ' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.417 -10.065 2 C3'-C2'-C1' 114.777 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 1.126 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.246 1 C3'-C2'-C1' 114.994 8.781 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.463 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.942 1 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.463 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.927 1 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.5 ' C6 ' ' N1 ' ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.234 2 C3'-C2'-C1' 115.283 8.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.498 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.64 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.515 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.398 1 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.649 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.057 2 C3'-C2'-C1' 114.795 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.666 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.386 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.851 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.176 2 C3'-C2'-C1' 114.404 8.36 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.87 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.844 1 C3'-C2'-C1' 114.76 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.743 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.724 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.515 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.239 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.407 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.705 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.489 2 C3'-C2'-C1' 114.36 8.329 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 tpt . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.093 0.473 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -169.78 -38.2 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.298 -0.876 . . . . 0.0 110.716 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -100.5 149.91 23.21 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.665 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -92.21 -154.67 0.39 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.366 -0.834 . . . . 0.0 108.786 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.56 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -69.81 41.47 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.088 -1.008 . . . . 0.0 110.72 179.849 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.56 ' HB2' ' O ' ' A' ' 5' ' ' THR . 34.1 m 79.49 50.43 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.77 -0.581 . . . . 0.0 110.072 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -172.12 39.79 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 O-C-N 121.366 -0.834 . . . . 0.0 111.536 -179.403 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.737 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.6 m -79.75 64.07 4.5 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.209 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.737 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.709 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.521 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.448 ' C ' HD21 ' A' ' 78' ' ' ASN 0.305 11.7 t-20 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.762 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.846 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.762 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.806 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.018 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.018 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.628 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.895 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.756 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 2.8 p90 -146.95 117.84 7.65 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.519 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 -95.54 178.11 1.56 Allowed Pre-proline 0 C--N 1.277 -2.586 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.818 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.523 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.674 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 12.6 m80 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.648 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.607 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.806 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.694 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.624 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.756 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.716 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.639 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.6 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.846 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.045 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.045 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 87' ' ' ILE . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.987 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.784 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.896 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.465 HD23 ' CB ' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.896 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.535 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.535 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.639 HG13 ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.536 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 101' ' ' THR . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 1.008 HD23 HD11 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.563 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.724 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.008 HD11 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 33.4 m80 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.645 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.943 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.987 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.821 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.643 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.075 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.943 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.876 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.075 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.627 ' HG3' HD22 ' A' ' 94' ' ' LEU . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.704 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.496 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.505 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.403 -11.486 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.534 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.665 3 C3'-C2'-C1' 113.611 7.794 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.534 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.305 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.566 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.012 1 C3'-C2'-C1' 114.883 8.702 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.566 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.052 2 C3'-C2'-C1' 114.59 8.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.523 " H2'" ' H71' ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.02 2 C3'-C2'-C1' 114.209 8.221 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.599 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.407 -11.112 1 C3'-C2'-C1' 114.291 8.279 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.599 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.829 8.663 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.437 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.998 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.554 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 115.123 8.874 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.554 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.724 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.661 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.664 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -10.975 1 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.591 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.57 2 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.535 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.241 2 C3'-C2'-C1' 115.705 9.29 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.535 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.689 2 C3'-C2'-C1' 114.951 8.751 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.526 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.526 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.472 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.157 2 C3'-C2'-C1' 114.381 8.344 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.563 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.563 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.416 -10.159 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.876 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.312 1 C3'-C2'-C1' 114.854 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.478 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.002 1 C3'-C2'-C1' 115.016 8.797 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.58 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.847 2 C3'-C2'-C1' 114.467 8.405 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.58 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.094 1 C3'-C2'-C1' 115.106 8.861 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.47 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.725 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.513 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.445 1 C3'-C2'-C1' 114.783 8.631 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.513 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.031 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.704 2 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.92 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.674 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.408 -11.01 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.895 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.816 2 C3'-C2'-C1' 114.966 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.824 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.573 1 C3'-C2'-C1' 115.615 9.225 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.162 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.418 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.781 2 C3'-C2'-C1' 114.693 8.567 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.379 2 C3'-C2'-C1' 114.298 8.284 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.12 0.486 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' HG21 ' A' ' 8' ' ' THR . 0.4 OUTLIER 51.88 35.61 16.11 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.396 -0.815 . . . . 0.0 110.195 -179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.439 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 13.5 mtmt -54.06 132.94 43.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.418 -0.802 . . . . 0.0 110.474 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.57 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -111.21 -154.66 0.55 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 121.268 -0.895 . . . . 0.0 108.811 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.594 ' O ' HG23 ' A' ' 5' ' ' THR . 11.9 t -66.35 49.2 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.288 -0.882 . . . . 0.0 109.868 179.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.668 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 1.8 t 79.55 101.44 0.06 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.669 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 4.4 mt 94.57 80.28 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 122.108 0.956 . . . . 0.0 111.527 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.507 HG21 ' O ' ' A' ' 2' ' ' LYS . 28.2 m -79.92 64.64 4.82 Favored 'General case' 0 C--N 1.291 -1.935 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 177.031 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.536 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.894 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.047 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.698 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 12.3 t-20 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.81 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.779 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.832 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.013 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.013 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.55 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.616 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.764 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 1.8 p90 -144.75 123.67 12.73 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.642 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.914 ' HD2' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -72.34 178.42 1.38 Allowed Pre-proline 0 C--N 1.277 -2.577 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 176.031 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 1.047 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.698 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.812 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.934 ' HB3' " H4'" ' C' ' 234' ' ' ' DT' . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 1.177 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.423 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.586 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.524 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 30.9 m120 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.832 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.756 ' HB2' HG22 ' A' ' 28' ' ' VAL . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.613 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.764 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.798 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.798 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 38' ' ' SMC . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.518 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.595 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.451 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.914 ' HB2' ' HD2' ' A' ' 39' ' ' ARG . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.962 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 52.5 m-20 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.962 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 HG22 ' A' ' 123' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.797 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.733 HG23 ' CD1' ' A' ' 135' ' ' TRP . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.497 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.655 ' HB ' ' HD3' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.655 ' HD3' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.534 HG13 ' HA ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.653 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.949 HD23 HD11 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.781 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.651 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.431 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.431 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.578 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.878 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.0 t60 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.949 HD11 HD23 ' A' ' 105' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.534 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.647 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.71 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.953 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.952 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.931 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.505 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.96 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.953 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 1.031 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.96 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.649 ' OE1' HD13 ' A' ' 94' ' ' LEU . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.733 ' CD1' HG23 ' A' ' 88' ' ' THR . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.497 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.432 ' HG2' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.565 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.258 1 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.565 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.658 3 C3'-C2'-C1' 113.859 7.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.461 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.03 1 C3'-C2'-C1' 115.004 8.788 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.461 " O5'" H2'' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.043 8.816 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 ' N1 ' ' N1 ' ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.848 1 C3'-C2'-C1' 114.742 8.602 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.558 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.439 8.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.622 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.005 8.075 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.622 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.617 " H4'" ' HG3' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.83 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.552 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.685 1 C3'-C2'-C1' 115.135 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.383 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.878 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.408 -10.953 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.679 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.907 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.619 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.556 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.264 2 C3'-C2'-C1' 115.839 9.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.667 2 C3'-C2'-C1' 115.011 8.793 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.503 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.85 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.492 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.373 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.47 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.019 2 C3'-C2'-C1' 114.368 8.334 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.609 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.288 1 C3'-C2'-C1' 114.574 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.613 ' OP1' ' HE3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.209 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 1.031 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.205 1 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.477 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.298 1 C3'-C2'-C1' 115.038 8.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.534 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.905 1 C3'-C2'-C1' 114.318 8.298 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.522 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.114 1 C3'-C2'-C1' 115.309 9.006 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.497 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.755 2 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.44 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.658 1 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.469 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.912 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.659 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.828 2 C3'-C2'-C1' 114.86 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.659 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.355 2 C3'-C2'-C1' 114.843 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.577 ' N1 ' ' N1 ' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.689 2 C3'-C2'-C1' 114.125 8.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.934 " H4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 1.177 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.563 9.188 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.488 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 2 C3'-C2'-C1' 114.787 8.634 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.414 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.665 2 C3'-C2'-C1' 114.531 8.45 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.414 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.309 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.076 0.465 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.88 -44.14 0.48 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.484 -0.76 . . . . 0.0 111.405 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.76 118.64 2.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.971 -1.081 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.07 -154.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.425 -0.797 . . . . 0.0 110.011 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -71.83 41.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.214 -0.929 . . . . 0.0 111.208 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 79.53 94.12 0.05 Allowed 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.316 -0.865 . . . . 0.0 109.883 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.5 -19.73 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 111.477 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m -79.79 64.23 4.58 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.735 -1.228 . . . . 0.0 109.292 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.677 ' H ' HG22 ' A' ' 8' ' ' THR . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.786 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.751 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.751 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 13.2 t-20 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.621 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.766 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.624 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.935 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.935 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.615 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.915 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 -146.99 119.58 8.52 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.516 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 -85.71 167.28 25.43 Favored Pre-proline 0 C--N 1.286 -2.155 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.786 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.486 ' HD3' " H5'" ' B' ' 199' ' ' ' DA' . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.694 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.621 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.866 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.677 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.611 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.825 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.68 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.766 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.615 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.751 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.653 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.46 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 62' ' ' LEU . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.74 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.671 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.773 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.028 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 70.0 m-20 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.028 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.506 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.009 HD21 HG22 ' A' ' 123' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.774 HG13 HD13 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.922 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 1.035 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.922 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.035 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HG2' ' OXT' ' A' ' 139' ' ' ARG . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.585 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.955 ' CG1' HD23 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.746 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.809 HD23 HD21 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.631 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.455 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.608 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.747 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.809 HD21 HD23 ' A' ' 105' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.502 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.621 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.672 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.876 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . 1.009 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.803 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.597 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.597 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.018 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.876 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 1.03 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.457 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.018 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.857 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.857 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.469 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.534 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.301 1 C3'-C2'-C1' 114.709 8.578 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.534 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 2 C3'-C2'-C1' 113.764 7.903 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.439 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.988 1 C3'-C2'-C1' 114.873 8.695 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.519 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.519 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.05 2 C3'-C2'-C1' 114.738 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.661 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.97 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.661 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.833 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.596 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.037 2 C3'-C2'-C1' 114.922 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.439 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.601 8.501 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.565 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.77 1 C3'-C2'-C1' 115.132 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.565 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.982 2 C3'-C2'-C1' 114.517 8.441 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.747 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.721 1 C3'-C2'-C1' 114.617 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.663 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.818 1 C3'-C2'-C1' 114.616 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.595 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.58 2 C3'-C2'-C1' 114.679 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 115.729 9.306 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.596 2 C3'-C2'-C1' 114.858 8.684 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.508 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.422 -9.63 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.508 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.201 2 C3'-C2'-C1' 114.733 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.349 2 C3'-C2'-C1' 114.337 8.312 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.602 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.272 2 C3'-C2'-C1' 114.644 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.602 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 1.03 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.417 -10.119 1 C3'-C2'-C1' 114.929 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.459 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.025 1 C3'-C2'-C1' 114.999 8.785 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.621 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.041 2 C3'-C2'-C1' 114.578 8.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.615 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.965 1 C3'-C2'-C1' 115.241 8.958 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.509 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.824 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.499 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.435 1 C3'-C2'-C1' 114.728 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.547 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.03 2 C3'-C2'-C1' 114.713 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.009 2 C3'-C2'-C1' 114.946 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.446 2 C3'-C2'-C1' 115.073 8.838 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.74 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.384 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.915 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.709 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.771 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.717 2 C3'-C2'-C1' 115.561 9.186 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.485 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.4 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.417 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.714 2 C3'-C2'-C1' 114.518 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.417 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.455 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.37 0.605 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -129.88 167.56 17.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.271 -0.893 . . . . 0.0 110.072 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.9 123.15 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.264 -0.898 . . . . 0.0 110.242 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -82.34 -158.65 0.26 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.284 -0.885 . . . . 0.0 109.901 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.567 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -75.27 51.63 0.56 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.27 -0.894 . . . . 0.0 110.813 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.567 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.7 t 79.55 68.45 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.593 -0.692 . . . . 0.0 109.978 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.07 30.06 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.318 -0.864 . . . . 0.0 111.003 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.6 m -104.98 64.16 0.72 Allowed 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.219 -0.993 . . . . 0.0 109.294 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.918 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.071 ' NE1' HD11 ' A' ' 17' ' ' LEU . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.071 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.712 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 11.6 t-20 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.805 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.781 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.735 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.805 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.777 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.612 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.021 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.021 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.612 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.76 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.737 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.4 p90 -149.03 117.91 6.68 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.487 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER -87.26 171.73 9.34 Favored Pre-proline 0 C--N 1.286 -2.169 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 177.701 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.698 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.442 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.677 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 1.047 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 10.3 m80 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.808 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.766 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.605 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.777 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.609 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.737 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.515 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.515 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.656 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.583 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NH1' ' HG3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.615 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.423 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.781 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.3 m-20 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.728 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.805 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.663 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.585 HD21 HG21 ' A' ' 101' ' ' THR . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.634 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.566 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.585 HG21 HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.853 HD21 ' NE2' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.814 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.827 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB2' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB2' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.827 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.427 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.62 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.582 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.8 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.814 HD21 HD23 ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.853 ' NE2' HD21 ' A' ' 102' ' ' LEU . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.578 HH22 ' H71' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.805 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.819 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.77 HG22 ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.822 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.118 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.819 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.945 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.683 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.118 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.634 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.473 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.509 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.346 1 C3'-C2'-C1' 114.686 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.531 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.641 3 C3'-C2'-C1' 113.615 7.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.531 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 115.181 8.915 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.521 " O5'" H2'' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.177 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.432 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.057 2 C3'-C2'-C1' 114.576 8.483 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.694 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.036 2 C3'-C2'-C1' 114.162 8.187 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.694 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.413 -10.534 2 C3'-C2'-C1' 114.111 8.151 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.602 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.251 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.432 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.634 8.524 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.576 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.814 1 C3'-C2'-C1' 115.18 8.914 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.597 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.183 1 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.8 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.648 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 114.595 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.673 8.552 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.531 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.208 2 C3'-C2'-C1' 115.875 9.411 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.531 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.716 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.716 2 C3'-C2'-C1' 114.851 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.377 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.33 2 C3'-C2'-C1' 114.385 8.346 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.555 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.42 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.582 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.417 -10.133 1 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.945 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.422 1 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.465 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.15 1 C3'-C2'-C1' 115.052 8.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.465 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.967 1 C3'-C2'-C1' 114.435 8.382 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.531 ' N2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.349 1 C3'-C2'-C1' 115.311 9.008 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.674 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.469 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.371 1 C3'-C2'-C1' 114.882 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.492 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.865 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.608 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.164 2 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.677 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.404 -11.43 1 C3'-C2'-C1' 114.581 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 1.047 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.68 2 C3'-C2'-C1' 114.881 8.7 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.866 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.684 1 C3'-C2'-C1' 115.485 9.132 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.501 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.474 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.78 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.4 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.393 2 C3'-C2'-C1' 114.242 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.494 ' HB2' ' NE2' ' A' ' 11' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -140.73 -164.23 1.69 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.332 -0.855 . . . . 0.0 110.222 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -108.8 -165.13 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.368 -0.832 . . . . 0.0 110.311 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.752 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -148.36 -154.17 0.54 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.402 -0.811 . . . . 0.0 109.072 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.542 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.4 m -55.15 46.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.487 -0.758 . . . . 0.0 111.931 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.752 ' N ' ' O ' ' A' ' 4' ' ' ALA . 1.4 t 79.56 96.11 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.527 -0.733 . . . . 0.0 112.36 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 1.4 mt 80.46 77.67 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 121.991 0.9 . . . . 0.0 112.444 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.622 ' OG1' ' HB3' ' A' ' 4' ' ' ALA . 20.3 m -86.66 63.44 7.98 Favored 'General case' 0 C--N 1.289 -2.026 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 176.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.566 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.558 ' H ' HG22 ' A' ' 8' ' ' THR . 0.6 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.96 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.066 ' NE1' HD11 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.477 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 12' ' ' ARG . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.066 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 11.0 t-20 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.653 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.768 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.781 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.066 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.066 HG22 HG12 ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.563 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.711 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -148.06 116.65 6.64 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.45 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 -86.83 178.15 2.41 Favored Pre-proline 0 C--N 1.285 -2.21 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 177.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.74 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.418 HH11 ' HG2' ' A' ' 71' ' ' ARG . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.765 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.73 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 9.4 m80 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.794 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.627 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.729 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.781 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.768 ' HB2' HG22 ' A' ' 28' ' ' VAL . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.607 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.705 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.749 HD21 ' HG3' ' A' ' 68' ' ' PRO . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.406 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.749 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.523 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.512 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.789 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.998 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 72.4 m-20 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.998 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.725 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.47 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.966 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.742 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.633 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.633 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.608 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.688 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.843 HD23 ' HB2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 1.032 HD23 HD13 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.797 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.797 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.745 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.843 ' HB2' HD23 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.797 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.032 HD13 HD23 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.824 ' NE2' HD21 ' A' ' 102' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.61 ' HD3' ' O6 ' ' B' ' 202' ' ' ' DG' . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.753 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.722 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.966 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.828 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.004 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.666 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.527 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.666 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.004 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 94' ' ' LEU . 1.7 tt0 -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.498 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.256 1 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.558 3 C3'-C2'-C1' 113.519 7.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.462 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.915 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.053 2 C3'-C2'-C1' 114.897 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.544 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.679 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.562 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.075 2 C3'-C2'-C1' 114.338 8.313 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.606 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.766 1 C3'-C2'-C1' 114.1 8.143 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.606 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.895 8.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.432 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.933 2 C3'-C2'-C1' 114.654 8.539 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.59 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.729 1 C3'-C2'-C1' 115.036 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.59 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.943 2 C3'-C2'-C1' 114.603 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.797 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.614 1 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.657 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.626 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.56 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.879 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.567 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 115.693 9.28 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.567 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.864 2 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.528 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.828 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.498 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.268 2 C3'-C2'-C1' 114.823 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.543 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.404 -11.383 2 C3'-C2'-C1' 114.455 8.397 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.69 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.69 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.139 1 C3'-C2'-C1' 114.725 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.667 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.612 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.581 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.581 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.958 1 C3'-C2'-C1' 115.267 8.976 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.697 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.463 1 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.621 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.072 2 C3'-C2'-C1' 114.662 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.027 2 C3'-C2'-C1' 114.731 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.236 2 C3'-C2'-C1' 114.916 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.635 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.401 -11.7 2 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.765 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.413 -10.511 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.704 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 115.593 9.209 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.485 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.411 -10.685 2 C3'-C2'-C1' 114.624 8.517 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.47 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' A' ' 2' ' ' LYS . 20.5 mtt . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.06 0.457 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' CB ' ' O ' ' A' ' 1' ' ' MET . 20.3 tttm 68.72 -1.77 1.89 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 111.206 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp 46.57 57.8 5.16 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.089 -1.007 . . . . 0.0 111.338 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 7' ' ' LEU . . . -64.91 163.74 13.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.149 -0.969 . . . . 0.0 110.089 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.9 p -99.88 72.1 1.7 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.357 -0.84 . . . . 0.0 109.583 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 5' ' ' THR . 2.4 t 79.77 25.88 0.38 Allowed 'General case' 0 N--CA 1.499 2.011 0 CA-C-O 121.28 0.562 . . . . 0.0 109.54 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 4' ' ' ALA . 10.0 mt -110.09 -44.25 3.81 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.402 -0.811 . . . . 0.0 110.29 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.76 HG22 ' H ' ' A' ' 11' ' ' GLN . 62.8 m -81.62 63.51 5.93 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.827 -1.149 . . . . 0.0 108.107 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.555 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.76 ' H ' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.654 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.05 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.748 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.05 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.581 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 11.8 t-20 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.69 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.627 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.79 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.56 ' HA ' ' O ' ' A' ' 36' ' ' ILE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.049 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.049 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.711 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.957 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.79 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 -148.82 118.63 7.08 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.58 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 -79.55 165.17 49.79 Favored Pre-proline 0 C--N 1.291 -1.955 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.748 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.444 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 10.4 m80 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 30.6 m120 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.769 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.602 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.74 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.745 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.416 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.745 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.612 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.47 ' O ' ' HD2' ' A' ' 74' ' ' PRO . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.507 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.791 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.992 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 70.4 m-20 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.992 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.791 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.0 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.775 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.775 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.677 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.511 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.836 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.49 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.614 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 98' ' ' THR . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.959 HD13 ' N ' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.959 ' N ' HD13 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.668 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.536 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.607 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.895 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.845 ' HB2' HD11 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.535 ' N ' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.56 ' O ' HD23 ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.771 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.755 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' THR . . . . . 1.0 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.905 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.755 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.658 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.722 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.836 ' CD ' HD22 ' A' ' 94' ' ' LEU . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.49 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.492 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.212 1 C3'-C2'-C1' 114.761 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.492 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.635 3 C3'-C2'-C1' 113.641 7.815 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.457 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.88 1 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.228 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.505 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.062 2 C3'-C2'-C1' 114.809 8.649 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.598 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.419 -9.938 2 C3'-C2'-C1' 114.111 8.15 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.611 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.835 2 C3'-C2'-C1' 114.168 8.192 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.611 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.025 2 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.444 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.833 2 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.59 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.594 1 C3'-C2'-C1' 115.236 8.954 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.59 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.895 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.723 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.658 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.551 8.465 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.573 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 2 C3'-C2'-C1' 114.477 8.412 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 114.943 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.52 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.712 8.58 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.27 2 C3'-C2'-C1' 114.149 8.178 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.633 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.327 2 C3'-C2'-C1' 114.538 8.456 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.633 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.156 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.886 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.414 1 C3'-C2'-C1' 114.878 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.47 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.038 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.47 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.226 2 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.541 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.065 1 C3'-C2'-C1' 115.249 8.963 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.541 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.629 2 C3'-C2'-C1' 114.629 8.521 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.461 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.339 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.593 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.146 2 C3'-C2'-C1' 114.802 8.645 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.784 2 C3'-C2'-C1' 114.9 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.408 2 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.612 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.211 1 C3'-C2'-C1' 114.566 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.957 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.594 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.832 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.762 2 C3'-C2'-C1' 115.483 9.131 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.493 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.246 2 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.44 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.504 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.44 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.444 2 C3'-C2'-C1' 114.273 8.266 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 ttp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.212 0.53 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -106.06 150.81 25.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -169.32 156.05 6.68 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.428 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -129.13 -154.37 0.63 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 5' ' ' THR . 10.1 t -62.19 46.8 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.349 -0.844 . . . . 0.0 110.357 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.692 ' N ' ' O ' ' A' ' 4' ' ' ALA . 35.1 m 79.62 107.16 0.07 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.92 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.665 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 6.1 mt 93.81 75.83 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 CA-C-O 121.837 0.827 . . . . 0.0 113.161 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.601 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m -97.16 64.26 1.93 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 175.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.564 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 1.038 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.038 HG23 ' O ' ' A' ' 12' ' ' ARG . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.477 ' C ' HD21 ' A' ' 78' ' ' ASN 0.3 11.9 t-20 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.908 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.666 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.908 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.779 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.778 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.064 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.064 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.616 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.909 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 -148.96 115.76 5.98 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.532 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 -93.94 178.35 1.59 Allowed Pre-proline 0 C--N 1.287 -2.143 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.786 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.542 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.699 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 1.051 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 9.6 m80 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.865 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.633 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.809 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.778 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.779 ' HB2' HG22 ' A' ' 28' ' ' VAL . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.656 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.729 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.703 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.583 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' OP1' ' C' ' 232' ' ' ' DA' . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.542 ' HG3' ' HD3' ' A' ' 43' ' ' ARG 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.668 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.733 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.035 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.035 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.766 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.655 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.803 HD22 ' NE2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.447 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.498 HD22 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.476 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.706 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.8 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.457 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.766 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.89 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.918 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.65 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.669 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.918 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.803 ' NE2' HD22 ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.529 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.327 1 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.529 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.403 -11.548 2 C3'-C2'-C1' 113.542 7.744 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.501 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.881 1 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.533 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.533 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.855 2 C3'-C2'-C1' 114.664 8.546 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.554 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.039 2 C3'-C2'-C1' 114.268 8.263 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.601 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.906 1 C3'-C2'-C1' 114.128 8.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.601 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.821 8.658 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.459 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.773 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.587 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.722 1 C3'-C2'-C1' 115.192 8.923 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.587 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.659 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.8 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.624 1 C3'-C2'-C1' 114.649 8.535 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.656 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.048 1 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.644 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.538 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.191 2 C3'-C2'-C1' 115.827 9.376 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.636 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.524 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.92 2 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.506 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.335 2 C3'-C2'-C1' 114.762 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.518 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.303 2 C3'-C2'-C1' 114.379 8.342 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.682 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.434 2 C3'-C2'-C1' 114.602 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.706 ' H73' ' CZ ' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.419 -9.857 1 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.714 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.4 1 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.491 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 115.062 8.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.491 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.991 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.504 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.203 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.701 2 C3'-C2'-C1' 114.7 8.571 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.49 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.409 1 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.555 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.631 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.936 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.631 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.606 " H3'" HD13 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.404 -11.426 1 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 1.051 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.711 2 C3'-C2'-C1' 114.859 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.83 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 115.497 9.141 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.499 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.372 2 C3'-C2'-C1' 114.753 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.407 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.719 2 C3'-C2'-C1' 114.525 8.446 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . 0.407 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 114.312 8.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.228 0.537 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -151.6 -57.75 0.15 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.325 -0.86 . . . . 0.0 110.148 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 26.5 mtmt 56.48 166.4 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.521 -0.737 . . . . 0.0 110.547 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -112.92 -154.67 0.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.133 -0.979 . . . . 0.0 108.513 179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.554 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.5 m -66.8 48.28 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.201 -0.937 . . . . 0.0 110.037 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.554 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.3 t 79.51 40.15 0.09 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.749 -0.594 . . . . 0.0 109.589 -179.204 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 168.19 75.93 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.678 0.752 . . . . 0.0 110.819 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.3 m -80.03 63.56 4.58 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.489 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.644 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.819 ' O ' HG23 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.029 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.029 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 12.5 t-20 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.773 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.777 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.78 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.015 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.015 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.646 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.894 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 -148.46 118.1 7.04 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.56 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 -84.43 170.08 14.83 Favored Pre-proline 0 C--N 1.287 -2.13 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 177.441 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.708 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.525 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.812 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.9 m80 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.653 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.679 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.78 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.679 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.714 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.691 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.777 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.017 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 67.2 m-20 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.017 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.917 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.776 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.765 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.765 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.54 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.677 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.677 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.73 HG13 ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.725 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.822 ' HG ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.606 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.508 ' HB3' HD13 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.617 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.845 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.822 HD13 ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.627 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.573 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.714 ' HD2' ' HA ' ' A' ' 126' ' ' MET 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.917 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.697 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.714 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.929 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.648 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.913 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.5 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.929 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 6.1 tm0? -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.503 ' CD1' HG23 ' A' ' 88' ' ' THR 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.539 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.322 1 C3'-C2'-C1' 114.703 8.574 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.765 3 C3'-C2'-C1' 113.655 7.825 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.532 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.945 1 C3'-C2'-C1' 114.891 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.536 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.158 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.596 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.976 2 C3'-C2'-C1' 114.18 8.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.614 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.858 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.614 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.975 2 C3'-C2'-C1' 114.949 8.749 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.525 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.863 2 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.616 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.661 1 C3'-C2'-C1' 115.142 8.887 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.616 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.104 2 C3'-C2'-C1' 114.67 8.55 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.845 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.409 -10.874 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.693 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.819 1 C3'-C2'-C1' 114.558 8.47 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.581 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.529 2 C3'-C2'-C1' 114.653 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.549 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.549 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.773 2 C3'-C2'-C1' 114.954 8.753 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.507 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.804 2 C3'-C2'-C1' 114.904 8.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.488 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . 0.54 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.397 8.355 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.569 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.564 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.88 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.714 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.913 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.436 1 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.52 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.042 1 C3'-C2'-C1' 114.938 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.52 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.499 8.428 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.524 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.138 1 C3'-C2'-C1' 115.259 8.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.518 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.643 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.511 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.533 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.104 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.6 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.933 2 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.6 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 115.189 8.921 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.622 8.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.894 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.674 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.842 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.494 9.139 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.466 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.263 2 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.41 -10.785 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.429 2 C3'-C2'-C1' 114.287 8.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptp . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.149 0.5 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.428 ' C ' ' HG3' ' A' ' 3' ' ' LYS . 10.3 mmtp -84.57 -169.82 2.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.269 -0.894 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.758 ' O ' ' N ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -139.25 86.42 2.13 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.404 -0.81 . . . . 0.0 110.633 -179.537 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.627 ' HA ' ' H ' ' A' ' 8' ' ' THR . . . -39.39 72.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.549 -0.719 . . . . 0.0 112.824 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.758 ' N ' ' O ' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -73.69 70.49 1.37 Allowed 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 177.601 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 5' ' ' THR . 68.3 m 95.17 28.19 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER 81.47 88.97 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 123.951 1.834 . . . . 0.0 111.341 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.627 ' H ' ' HA ' ' A' ' 4' ' ' ALA . 19.2 m -79.59 64.66 4.53 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 112.015 -2.357 . . . . 0.0 106.972 177.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.653 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.521 ' H ' HG22 ' A' ' 8' ' ' THR . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 1.049 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.049 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.688 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.467 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 20' ' ' ASP . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.476 ' C ' HD21 ' A' ' 78' ' ' ASN 0.303 11.5 t-20 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.991 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.978 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.842 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.991 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' ' 55' ' ' TYR . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.042 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.042 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.665 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.886 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.75 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 -145.67 118.22 8.56 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SMC . . . . . 0.548 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.978 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 -83.71 178.11 2.61 Favored Pre-proline 0 C--N 1.285 -2.196 0 CA-C-N 113.485 -1.689 . . . . 0.0 106.75 178.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.741 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.741 ' HB2' ' NH1' ' A' ' 43' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.921 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 11.3 m80 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.624 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.632 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.844 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.767 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.789 ' HB2' HG22 ' A' ' 28' ' ' VAL . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.427 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.75 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.774 HD21 ' HG3' ' A' ' 68' ' ' PRO . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.774 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.573 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.728 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.842 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.025 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 1.025 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.738 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.494 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.823 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.788 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.602 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.587 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.456 HD21 ' NE2' ' A' ' 117' ' ' HIS . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.617 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.769 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' MET . . . . . 0.532 ' SD ' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.45 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.45 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.561 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.685 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.638 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.513 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.722 ' HG ' HG11 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.613 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.937 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.823 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.675 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.491 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' THR . . . . . 1.105 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' PRO . . . . . 0.937 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.989 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.502 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 1.105 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.792 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' TRP . . . . . 0.785 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.602 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 190' ' ' ' DG' . . . . . 0.494 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.222 1 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 191' ' ' ' DC' . . . . . 0.494 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.662 2 C3'-C2'-C1' 113.621 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 192' ' ' ' DA' . . . . . 0.501 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.884 1 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 193' ' ' ' DA' . . . . . 0.565 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.204 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 194' ' ' ' DA' . . . . . 0.565 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.723 2 C3'-C2'-C1' 114.762 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 195' ' ' ' DT' . . . . . 0.562 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.056 2 C3'-C2'-C1' 114.238 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 196' ' ' ' DT' . . . . . 0.626 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.966 1 C3'-C2'-C1' 114.241 8.243 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 197' ' ' ' DA' . . . . . 0.626 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.084 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 198' ' ' ' DA' . . . . . 0.487 " H4'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.943 1 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 199' ' ' ' DA' . . . . . 0.582 " H5'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.41 -10.76 1 C3'-C2'-C1' 115.136 8.883 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 200' ' ' ' DG' . . . . . 0.576 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.962 2 C3'-C2'-C1' 114.544 8.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 201' ' ' ' DC' . . . . . 0.696 " O5'" ' H6 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 3 C3'--C2' 1.409 -10.903 1 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . 0.668 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.862 1 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 203' ' ' ' DC' . . . . . 0.564 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.509 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 115.811 9.365 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 114.901 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 206' ' ' ' DG' . . . . . 0.54 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.731 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' B' B ' 207' ' ' ' DA' . . . . . 0.54 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.3 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.406 -11.244 2 C3'-C2'-C1' 114.182 8.202 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . 0.583 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.252 2 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 223' ' ' ' DT' . . . . . 0.583 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.07 1 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 224' ' ' ' DT' . . . . . 0.989 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.278 1 C3'-C2'-C1' 114.82 8.657 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 225' ' ' ' DG' . . . . . 0.468 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.045 1 C3'-C2'-C1' 114.977 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 226' ' ' ' DC' . . . . . 0.621 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.704 2 C3'-C2'-C1' 114.511 8.436 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 227' ' ' ' DG' . . . . . 0.621 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.955 1 C3'-C2'-C1' 115.133 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 228' ' ' ' DC' . . . . . 0.452 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.865 2 C3'-C2'-C1' 114.663 8.545 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 229' ' ' ' DT' . . . . . 0.492 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.424 1 C3'-C2'-C1' 114.915 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 230' ' ' ' DT' . . . . . 0.492 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.976 1 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 231' ' ' ' DT' . . . . . 0.609 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.879 2 C3'-C2'-C1' 114.87 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 232' ' ' ' DA' . . . . . 0.609 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 2 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 233' ' ' ' DA' . . . . . 0.611 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.405 -11.312 2 C3'-C2'-C1' 114.625 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 234' ' ' ' DT' . . . . . 0.921 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 114.843 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 235' ' ' ' DT' . . . . . 0.799 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.675 2 C3'-C2'-C1' 115.505 9.147 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 236' ' ' ' DT' . . . . . 0.486 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.345 2 C3'-C2'-C1' 114.797 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 237' ' ' ' DG' . . . . . 0.405 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.408 -10.964 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear build full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.384 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.4 m . . . . . 0 N--CA 1.465 0.302 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.574 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.57 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.837 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.57 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 12' ' ' ARG . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.2 t30 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.775 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.775 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.754 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.99 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.99 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.68 HG22 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.69 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.78 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.659 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.659 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.736 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.5 m-70 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 48' ' ' LEU . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.617 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.775 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.744 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.606 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.749 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.55 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.629 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.732 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.732 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.482 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.51 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.632 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.724 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.875 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.997 HD23 ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.812 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 18.4 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 1.117 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.661 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.661 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.746 HG12 HD11 ' A' ' 102' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 1.117 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.78 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.78 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 109' ' ' VAL . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.498 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.619 ' CB ' HD22 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.485 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.603 HD12 ' HE1' ' A' ' 111' ' ' MET . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.875 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.771 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.875 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.925 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.771 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.485 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.543 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.925 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.812 ' OE1' HD22 ' A' ' 94' ' ' LEU . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.565 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.418 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.798 HG22 ' H ' ' A' ' 11' ' ' GLN . 72.1 m . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.575 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.798 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.061 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.515 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.061 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.858 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.679 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.858 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.727 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.827 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.692 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.067 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.067 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.645 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.592 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.755 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.62 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.785 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.471 ' CZ ' ' NH2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.722 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.722 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.9 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.3 m-70 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.659 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.79 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.681 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.827 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.727 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.612 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.681 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.447 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' NH2' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.706 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.736 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.97 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.97 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.985 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.709 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.87 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.87 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.585 HD23 ' OG1' ' A' ' 101' ' ' THR . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.678 ' HG ' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.466 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.541 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.767 HG12 ' CD1' ' A' ' 102' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.814 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.866 HD23 HD12 ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.744 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.543 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.543 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.744 ' HB2' ' SD ' ' A' ' 111' ' ' MET . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.866 HD12 HD23 ' A' ' 102' ' ' LEU . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.412 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.64 ' C ' HD13 ' A' ' 119' ' ' LEU . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.694 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.743 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.985 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.736 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.712 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.743 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.608 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.749 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.722 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.722 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.491 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.776 HG22 ' H ' ' A' ' 11' ' ' GLN . 94.0 m . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.776 ' H ' HG22 ' A' ' 8' ' ' THR . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.869 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.579 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.869 HG23 ' O ' ' A' ' 12' ' ' ARG . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.649 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.1 t30 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.851 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.762 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.824 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.769 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.81 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.983 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.983 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.775 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.76 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 . . . . . 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.941 ' HD3' ' HB2' ' A' ' 77' ' ' ALA 0.261 6.0 mtt180 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.735 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.649 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.632 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.777 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.3 m-70 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.725 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.718 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.769 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.7 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.748 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.728 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.459 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.631 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.941 ' HB2' ' HD3' ' A' ' 39' ' ' ARG . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.93 HD21 HG22 ' A' ' 123' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.798 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.404 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.436 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.768 ' HG ' HG12 ' A' ' 100' ' ' VAL 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.579 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.579 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.768 HG12 ' HG ' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.457 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.877 HD21 HD12 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.428 ' H ' ' H ' ' A' ' 102' ' ' LEU . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.926 HD23 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.743 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.719 ' CE ' ' HB3' ' A' ' 115' ' ' HIS . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.719 ' HB3' ' CE ' ' A' ' 111' ' ' MET . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.926 HD21 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.602 ' NE2' HD23 ' A' ' 102' ' ' LEU . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.56 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.675 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.79 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.93 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.646 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.056 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.79 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.565 ' HD2' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.056 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.756 ' NE2' HD22 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.826 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.463 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.758 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.597 ' H ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.468 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.724 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.3 1.3 t30 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.852 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.772 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.852 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.805 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.016 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.016 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.596 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 37' ' ' PHE . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 . . . . . 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.797 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.599 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.833 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.3 m-70 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.771 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.761 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.805 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.788 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.715 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.689 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.554 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.697 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 73' ' ' GLN . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.425 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.772 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 123' ' ' THR . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.851 HD12 HD13 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.955 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.489 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.747 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.955 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.752 HD21 ' OE1' ' A' ' 97' ' ' GLU . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.838 ' CD1' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.504 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.752 ' OE1' HD21 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.604 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.849 ' CG1' HD13 ' A' ' 102' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.734 ' OG1' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.849 HD13 ' CG1' ' A' ' 100' ' ' VAL . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.756 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.634 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.661 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.58 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.654 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.679 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.687 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.611 HG22 ' HA ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.613 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.966 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.687 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.634 ' HE2' ' CD1' ' A' ' 114' ' ' PHE . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.966 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.815 ' HG3' HD23 ' A' ' 94' ' ' LEU . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.597 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.8 m . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.053 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 12' ' ' ARG . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.053 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.3 t30 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.771 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.757 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.787 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.037 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.037 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.536 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.747 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 . . . . . 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.699 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.499 ' HD2' ' HG2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.546 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.646 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.2 m-70 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.801 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.787 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.757 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.611 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.703 HD21 ' HG3' ' A' ' 68' ' ' PRO . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.712 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.499 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.543 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.712 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.771 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.004 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.004 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.058 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.919 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.893 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.814 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.893 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 93' ' ' LEU . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.814 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.832 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.841 ' C ' HD13 ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.735 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.832 ' CB ' HD23 ' A' ' 102' ' ' LEU . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.434 ' CE1' ' HE2' ' A' ' 129' ' ' LYS . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.735 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.585 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.919 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 1.058 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.777 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.595 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.979 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.719 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.467 ' NZ ' ' CD2' ' A' ' 117' ' ' HIS . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.979 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.652 ' HG3' HD22 ' A' ' 94' ' ' LEU . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.583 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.507 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.459 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.496 ' H ' HG22 ' A' ' 8' ' ' THR . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 16' ' ' VAL . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.069 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.963 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.069 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.521 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 22' ' ' ASN . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.482 ' C ' HD21 ' A' ' 78' ' ' ASN 0.316 1.2 t30 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.564 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.964 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.964 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.667 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.585 HG22 ' N ' ' A' ' 37' ' ' PHE . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.773 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 . . . . . 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.681 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.963 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.463 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.831 ' HE1' HG12 ' A' ' 16' ' ' VAL . 3.8 m-70 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.938 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.68 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.782 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.726 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.717 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.606 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.741 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.812 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.812 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.449 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' CD ' ' A' ' 74' ' ' PRO . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.634 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.562 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.506 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.634 ' HB3' ' O ' ' A' ' 71' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' CG ' ' A' ' 80' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.681 ' HB2' ' NH2' ' A' ' 39' ' ' ARG . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.973 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m120 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.973 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.408 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.781 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.76 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.817 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.778 HD12 ' O ' ' A' ' 90' ' ' ALA 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.649 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.649 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.868 HD22 HD13 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.797 HG11 ' CE ' ' A' ' 111' ' ' MET . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.797 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.521 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.668 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.668 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 84' ' ' LEU . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.781 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.932 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.668 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.432 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.808 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.932 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 94' ' ' LEU . 3.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.531 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.488 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.5 m . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.578 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.673 ' H ' HG22 ' A' ' 8' ' ' THR . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.982 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.593 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.982 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 1.2 t30 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.814 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.736 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.824 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.999 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.999 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.556 HG22 ' N ' ' A' ' 37' ' ' PHE . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 . . . . . 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.697 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.747 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.554 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.854 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.585 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.882 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.633 HG22 ' CD1' ' A' ' 29' ' ' PHE . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.824 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.736 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.805 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.733 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.013 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.013 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.733 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.012 HD21 ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.848 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.868 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.848 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 96' ' ' GLN . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.14 HD11 HD13 ' A' ' 102' ' ' LEU . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.66 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.667 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.667 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.621 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 94' ' ' LEU . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.14 HD13 HD11 ' A' ' 94' ' ' LEU . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.971 HD12 HD13 ' A' ' 116' ' ' LEU . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.715 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.539 ' HE2' ' HB3' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.915 ' HA ' HD23 ' A' ' 116' ' ' LEU . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.567 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.539 ' HB3' ' HE2' ' A' ' 111' ' ' MET . 4.2 t60 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.036 HD21 HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.638 ' ND1' ' HG3' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.716 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.903 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.678 ' HB ' HD13 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 1.012 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.016 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.903 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.638 ' HG3' ' ND1' ' A' ' 117' ' ' HIS . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.016 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.562 ' HG2' HD23 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.715 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.453 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.66 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.449 ' O ' ' N ' ' A' ' 10' ' ' ASP . 20.6 m . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.623 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.628 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.876 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.022 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.628 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.876 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.022 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.1 t30 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.783 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.537 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.799 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.76 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.848 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.581 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.916 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.916 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.536 HG22 ' N ' ' A' ' 37' ' ' PHE . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.726 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 . . . . . 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.783 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.746 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.646 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.841 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.0 m-70 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.59 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.848 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.76 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.502 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.764 ' HB1' HE22 ' A' ' 73' ' ' GLN . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.592 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.708 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.633 ' HG3' HD21 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.764 HE22 ' HB1' ' A' ' 58' ' ' ALA . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.714 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.752 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.011 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.3 m120 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.011 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.996 HD21 ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.854 ' HE3' HD13 ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.727 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.792 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.669 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.8 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.668 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.668 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.599 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.573 HG11 HD23 ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 102' ' ' LEU . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.854 HD13 ' HE3' ' A' ' 86' ' ' LYS . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.636 ' HB2' ' CD1' ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.784 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.477 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.429 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.831 ' HA ' HD11 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.476 ' HA ' ' CG ' ' A' ' 118' ' ' ARG . 3.5 t60 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.657 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.582 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.666 HG22 HD22 ' A' ' 84' ' ' LEU . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.996 ' HA ' HD21 ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.787 HG22 ' HB3' ' A' ' 130' ' ' ALA . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.623 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.787 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.8 ' OE1' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.675 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.447 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.807 ' O ' HG23 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.026 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.026 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.701 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.3 t30 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.691 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.799 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.691 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.738 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.82 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.992 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.992 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.539 HG22 ' N ' ' A' ' 37' ' ' PHE . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.75 ' HD2' ' HB2' ' A' ' 77' ' ' ALA 0.297 1.3 mtm180 . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.722 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.701 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.561 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.685 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.5 m-70 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.782 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.709 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.738 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.732 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.761 HD21 ' HG3' ' A' ' 68' ' ' PRO . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.529 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.529 ' HD3' ' NE ' ' A' ' 43' ' ' ARG 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.526 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.7 m120 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.084 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.907 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 1.028 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.907 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.488 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.761 HD13 ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.028 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.772 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.761 ' OE1' HD13 ' A' ' 93' ' ' LEU . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.617 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.617 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.667 HG13 HD23 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.438 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.85 HD22 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.803 ' HE1' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.509 ' O ' ' HE3' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.539 ' HB3' ' HG3' ' A' ' 111' ' ' MET . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.85 HD11 HD22 ' A' ' 105' ' ' LEU . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.579 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.616 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.602 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.864 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 1.084 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.724 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.012 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.864 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.579 ' HD3' ' ND1' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.012 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.687 ' HG2' HD22 ' A' ' 94' ' ' LEU . 3.0 tt0 -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.765 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.772 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.752 HG22 ' H ' ' A' ' 11' ' ' GLN . 63.5 m . . . . . 0 N--CA 1.469 0.482 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.752 ' H ' HG22 ' A' ' 8' ' ' THR . 0.2 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.647 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 78' ' ' ASN 0.298 1.1 t30 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.825 ' C ' ' HB1' ' A' ' 77' ' ' ALA 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.815 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 56' ' ' ALA . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.814 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.085 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.085 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.559 HG22 ' N ' ' A' ' 37' ' ' PHE . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 . . . . . 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.772 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.455 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.679 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.893 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.1 m-70 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.68 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.635 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.834 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.787 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.764 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.814 ' HB2' HG22 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.672 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.788 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.659 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.648 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.825 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.807 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.402 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.758 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.502 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.637 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.637 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.693 HD22 ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.894 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.737 ' HE3' HG11 ' A' ' 109' ' ' VAL . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.693 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.645 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.894 HD21 HD23 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.516 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.758 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.745 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 121' ' ' LYS . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.889 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.084 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.745 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 117' ' ' HIS . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.084 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.569 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m . . . . . 0 N--CA 1.464 0.237 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.49 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.927 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.062 ' NE1' HD11 ' A' ' 17' ' ' LEU . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.49 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.928 HG12 ' HE1' ' A' ' 46' ' ' HIS . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.062 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.4 t30 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.734 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.796 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.934 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.934 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.627 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.561 ' HB ' HG23 ' A' ' 34' ' ' THR . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 5.2 p90 . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.774 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.928 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.4 m-70 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.796 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.492 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.708 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.665 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.8 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.501 ' C ' ' H ' ' A' ' 71' ' ' ARG . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.747 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.023 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.023 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 25.3 m170 -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.429 ' HB2' ' HD3' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.965 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.998 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.965 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.8 HD23 ' OG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.998 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.663 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.663 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.792 ' CG1' HD12 ' A' ' 102' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.8 ' OG1' HD23 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.926 ' CD2' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.761 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.596 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.411 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.508 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 4.2 t60 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 102' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.607 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.63 ' O ' HD23 ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.695 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.895 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 84' ' ' LEU . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.952 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.57 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.026 HG21 ' CE3' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.895 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.521 ' HE2' ' CE1' ' A' ' 117' ' ' HIS . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.495 ' HB3' HG23 ' A' ' 127' ' ' THR . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.026 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG3' HD22 ' A' ' 94' ' ' LEU . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.544 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.78 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.414 ' HA ' ' HG3' ' A' ' 95' ' ' GLU . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.737 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.6 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.508 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.737 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.709 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.521 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.448 ' C ' HD21 ' A' ' 78' ' ' ASN 0.305 1.2 t30 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.762 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.846 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.762 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.806 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.018 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.018 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.628 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 37' ' ' PHE . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.756 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 2.8 p90 . . . . . 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.818 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.49 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.804 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.7 m-70 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.648 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.607 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.806 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.694 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.624 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.756 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.716 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.6 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.846 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.045 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.045 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 87' ' ' ILE . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.987 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.784 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.896 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.465 HD23 ' CB ' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.896 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.535 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.535 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.639 HG13 ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.536 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 101' ' ' THR . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 1.008 HD23 HD11 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.008 HD11 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 77.2 m-70 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.645 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.943 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.987 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.821 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.643 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.075 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.943 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.075 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.627 ' HG3' HD22 ' A' ' 94' ' ' LEU . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.704 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.496 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ASP . 28.2 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.536 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.894 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.047 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.698 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 1.2 t30 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.81 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.779 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.832 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.013 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.013 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.55 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.491 HG22 ' N ' ' A' ' 37' ' ' PHE . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.764 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 1.8 p90 . . . . . 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.914 ' HD2' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 1.047 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.698 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.812 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.889 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.423 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.586 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.1 m-20 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.832 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.756 ' HB2' HG22 ' A' ' 28' ' ' VAL . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.613 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.764 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.798 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.798 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.454 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.595 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.451 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.914 ' HB2' ' HD2' ' A' ' 39' ' ' ARG . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.962 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.8 m120 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.962 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 HG22 ' A' ' 123' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.797 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.733 HG23 ' CD1' ' A' ' 135' ' ' TRP . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.497 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.655 ' HB ' ' HD3' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.655 ' HD3' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.534 HG13 ' HA ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.653 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.949 HD23 HD11 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.781 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.651 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.431 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.431 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 3.0 t60 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.949 HD11 HD23 ' A' ' 105' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.529 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.647 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.71 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.953 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.952 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.931 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.505 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.96 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.953 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.431 ' HZ3' ' CE1' ' A' ' 117' ' ' HIS . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.96 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.649 ' OE1' HD13 ' A' ' 94' ' ' LEU . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.733 ' CD1' HG23 ' A' ' 88' ' ' THR . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.497 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.432 ' HG2' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m . . . . . 0 N--CA 1.465 0.305 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.677 ' H ' HG22 ' A' ' 8' ' ' THR . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.786 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.751 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.751 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.621 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.766 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.624 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.935 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.935 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.615 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 . . . . . 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.786 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' NE ' ' HG3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.598 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.677 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.632 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.611 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.825 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.68 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.766 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.615 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.751 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.653 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.46 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 62' ' ' LEU . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ARG . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.671 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.773 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.028 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.028 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.506 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.009 HD21 HG22 ' A' ' 123' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.774 HG13 HD13 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.922 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 1.035 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.922 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.035 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HG2' ' OXT' ' A' ' 139' ' ' ARG . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.585 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.955 ' CG1' HD23 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.746 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.809 HD23 HD21 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.631 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.455 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.608 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.809 HD21 HD23 ' A' ' 105' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.502 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.672 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.876 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 1.009 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.803 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.597 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.597 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.018 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.876 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.502 ' N ' ' HB3' ' A' ' 117' ' ' HIS . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.018 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.857 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.857 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.469 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.6 m . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.918 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.071 ' NE1' HD11 ' A' ' 17' ' ' LEU . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.502 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 3.9 tt0 -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.956 HG12 ' HE1' ' A' ' 46' ' ' HIS . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.071 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.712 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.3 t30 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.805 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.781 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.735 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.805 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.777 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.612 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.021 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.021 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.612 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.555 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.737 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.4 p90 . . . . . 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.698 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.442 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.956 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.9 m-70 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.808 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.766 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.605 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.777 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.609 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.737 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.515 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.515 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.656 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.583 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NH1' ' HG3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.615 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.423 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.781 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.728 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.805 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.663 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.585 HD21 HG21 ' A' ' 101' ' ' THR . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.634 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.566 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.585 HG21 HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.853 HD21 ' NE2' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.814 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.827 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB2' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB2' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.827 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.427 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.62 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.814 HD21 HD23 ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.853 ' NE2' HD21 ' A' ' 102' ' ' LEU . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.805 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.819 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.77 HG22 ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.822 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.118 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.819 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.5 ' HB2' ' CG ' ' A' ' 117' ' ' HIS . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.118 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.634 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.473 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.3 m . . . . . 0 CA--C 1.519 -0.241 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.566 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.558 ' H ' HG22 ' A' ' 8' ' ' THR . 0.2 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.96 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.066 ' NE1' HD11 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.477 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.047 HG12 ' HE1' ' A' ' 46' ' ' HIS . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.066 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 1.2 t30 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.653 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.768 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.781 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.066 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.066 HG22 HG12 ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.563 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.561 HG22 ' N ' ' A' ' 37' ' ' PHE . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 . . . . . 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.74 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.418 HH11 ' HG2' ' A' ' 71' ' ' ARG . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.683 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 1.047 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.1 m-70 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.794 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.627 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.729 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.781 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.768 ' HB2' HG22 ' A' ' 28' ' ' VAL . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.607 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.705 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.749 HD21 ' HG3' ' A' ' 68' ' ' PRO . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.406 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.749 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.488 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.789 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.998 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.998 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.725 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.47 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.966 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.742 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.633 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.633 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.608 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.688 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.843 HD23 ' HB2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 1.032 HD23 HD13 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.797 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.797 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.745 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.843 ' HB2' HD23 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.414 ' N ' ' CD1' ' A' ' 114' ' ' PHE . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.032 HD13 HD23 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.824 ' NE2' HD21 ' A' ' 102' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 115' ' ' HIS . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.753 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.722 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.966 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.828 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.004 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.666 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.457 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.004 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.498 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.76 HG22 ' H ' ' A' ' 11' ' ' GLN . 62.8 m . . . . . 0 CA--C 1.519 -0.221 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.555 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.76 ' H ' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.654 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.05 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.748 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.05 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.581 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 1.2 t30 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.69 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.627 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.79 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.56 ' HA ' ' O ' ' A' ' 36' ' ' ILE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.049 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.049 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 30' ' ' ALA . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.79 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.748 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.642 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.3 m-70 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.634 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.1 m-20 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.769 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.602 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.74 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.745 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.416 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.745 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.567 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.47 ' O ' ' HD2' ' A' ' 74' ' ' PRO . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.507 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.791 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.992 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.992 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.791 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.0 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.775 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.775 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.677 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.511 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.836 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.49 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.614 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 98' ' ' THR . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.959 HD13 ' N ' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.959 ' N ' HD13 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.668 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.536 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.428 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 118' ' ' ARG . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.845 ' HB2' HD11 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.535 ' N ' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.56 ' O ' HD23 ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.771 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.755 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 1.0 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.905 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.755 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.722 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.836 ' CD ' HD22 ' A' ' 94' ' ' LEU . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.49 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.601 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.564 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 1.038 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.038 HG23 ' O ' ' A' ' 12' ' ' ARG . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.477 ' C ' HD21 ' A' ' 78' ' ' ASN 0.3 1.2 t30 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.908 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.666 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.908 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.779 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.778 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.064 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.064 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.616 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 37' ' ' PHE . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 . . . . . 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.786 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.542 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.699 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.987 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.0 m-70 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.865 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.633 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.809 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.778 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.779 ' HB2' HG22 ' A' ' 28' ' ' VAL . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.656 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.729 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.703 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 71' ' ' ARG . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.427 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.542 ' HG3' ' HD3' ' A' ' 43' ' ' ARG 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.668 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.733 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.035 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.035 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.766 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.655 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.803 HD22 ' NE2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.447 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.498 HD22 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.476 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.457 ' CD1' ' N ' ' A' ' 114' ' ' PHE . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.583 ' HB3' ' CG ' ' A' ' 111' ' ' MET . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 118' ' ' ARG . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.766 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.89 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.918 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.654 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.918 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.803 ' NE2' HD22 ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.3 m . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.489 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.644 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.819 ' O ' HG23 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.029 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.029 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 1.2 t30 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.773 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.777 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.78 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.015 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.015 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.646 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.56 HG22 ' N ' ' A' ' 37' ' ' PHE . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 . . . . . 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.708 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.771 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.9 m-70 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.653 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.679 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.78 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.679 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.714 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.467 ' C ' ' H ' ' A' ' 71' ' ' ARG . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.691 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.777 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.017 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.017 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.917 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.776 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.765 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.765 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.54 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.677 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.677 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.73 HG13 ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.725 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.822 ' HG ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.606 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.508 ' HB3' HD13 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.617 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 111' ' ' MET . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.822 HD13 ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.627 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.573 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.714 ' HD2' ' HA ' ' A' ' 126' ' ' MET 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.917 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.697 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.714 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.929 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.648 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.605 ' HE3' ' CE1' ' A' ' 117' ' ' HIS . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.5 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.929 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 0.9 OUTLIER -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.503 ' CD1' HG23 ' A' ' 88' ' ' THR 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.539 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 8' ' ' THR . 19.2 m . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.653 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.521 ' H ' HG22 ' A' ' 8' ' ' THR . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 1.049 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.049 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.688 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.467 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 20' ' ' ASP . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.476 ' C ' HD21 ' A' ' 78' ' ' ASN 0.303 1.1 t30 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.991 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.978 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.842 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.991 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' ' 55' ' ' TYR . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.042 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.042 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 37' ' ' PHE . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.75 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 . . . . . 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.978 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.741 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.741 ' HB2' ' NH1' ' A' ' 43' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.799 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.3 m-70 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.624 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.632 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.844 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.767 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.789 ' HB2' HG22 ' A' ' 28' ' ' VAL . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.427 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.75 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.774 HD21 ' HG3' ' A' ' 68' ' ' PRO . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.774 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.728 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.842 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.025 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 1.025 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.738 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.494 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.823 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.788 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.602 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.587 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.456 HD21 ' NE2' ' A' ' 117' ' ' HIS . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.617 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.769 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' MET . . . . . 0.532 ' SD ' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.45 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.45 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 118' ' ' ARG . 3.5 t60 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.638 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 115' ' ' HIS . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.722 ' HG ' HG11 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.613 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.937 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.823 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.675 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.491 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 1.105 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' PRO . . . . . 0.937 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 117' ' ' HIS . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 1.105 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.792 ' CD ' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' TRP . . . . . 0.785 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.602 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.194 0.521 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 51.58 91.84 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.29 -0.882 . . . . 0.0 110.384 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -132.16 121.1 23.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 110.707 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.52 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -67.82 -154.56 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.468 -0.77 . . . . 0.0 108.931 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.563 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.7 m -65.7 44.24 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.263 -0.898 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.46 36.25 0.15 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.445 -0.785 . . . . 0.0 110.259 179.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER 179.78 64.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.265 -0.897 . . . . 0.0 111.502 -179.462 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.4 m -80.64 63.93 5.24 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.574 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.8 p-10 -39.62 -31.58 0.1 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.867 -0.521 . . . . 0.0 110.497 -178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.97 -52.79 63.89 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.291 -0.881 . . . . 0.0 109.586 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.57 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -81.69 -27.29 34.06 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 117.389 -1.724 . . . . 0.0 109.461 178.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.837 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mmp_? -53.06 -43.03 66.35 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.278 -2.119 . . . . 0.0 105.278 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.0 t-105 -62.78 -40.77 98.32 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.57 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -60.1 -29.72 68.78 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.8 -34.51 57.95 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.177 0.989 . . . . 0.0 108.837 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 12' ' ' ARG . 56.1 t -70.03 -31.05 46.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.467 1.127 . . . . 0.0 111.069 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.261 1.4 mt -90.27 -32.16 16.66 Favored 'General case' 0 C--N 1.262 -3.221 0 CA-C-O 122.335 1.064 . . . . 0.0 108.331 -179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.16 -5.12 55.49 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.651 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 6.3 ptm180 51.92 40.51 28.24 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.006 0.907 . . . . 0.0 110.042 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 22' ' ' ASN . 44.1 t0 -69.73 110.22 6.1 Favored Pre-proline 0 C--N 1.298 -1.653 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.645 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -67.75 6.43 0.77 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.647 1.34 . . . . 0.0 110.001 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.3 1.2 t30 -102.16 -11.48 18.77 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 122.051 0.929 . . . . 0.0 109.181 -178.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.775 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.88 -5.9 15.99 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 122.537 1.16 . . . . 0.0 107.897 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.274 29.5 t0 -75.24 124.75 27.63 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.97 -35.65 4.73 Favored Glycine 0 N--CA 1.508 3.443 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -177.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -42.31 62.69 Favored 'General case' 0 C--N 1.309 -1.177 0 O-C-N 121.72 -0.87 . . . . 0.0 108.91 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.775 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 11.5 p90 -151.29 170.74 18.77 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.324 1.059 . . . . 0.0 111.103 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -126.74 175.45 8.74 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.754 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.87 120.4 16.07 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 118.072 -1.451 . . . . 0.0 109.263 176.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -101.09 114.97 29.41 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 114.896 -1.047 . . . . 0.0 113.302 -175.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.99 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.07 108.33 18.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.27 56.1 mtp180 -67.86 -19.98 65.09 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.98 0.895 . . . . 0.0 111.076 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.99 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.52 -31.13 72.22 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.84 0.829 . . . . 0.0 109.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.68 HG22 ' HB ' ' A' ' 31' ' ' VAL . 15.3 t -115.45 -12.17 11.73 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.107 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 74.35 33.34 56.68 Favored Glycine 0 N--CA 1.481 1.682 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 -179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.998 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 70.4 mt -125.09 165.68 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.305 -1.114 . . . . 0.0 109.347 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -145.9 118.3 8.47 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.54 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.69 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.279 4.0 mtp180 -87.86 173.71 6.08 Favored Pre-proline 0 C--N 1.287 -2.116 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.78 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.7 Cg_endo -69.27 -18.11 39.45 Favored 'Trans proline' 0 C--N 1.291 -2.456 0 O-C-N 123.155 1.081 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.8 p -115.26 30.68 7.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.85 -1.156 . . . . 0.0 112.217 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.5 t -46.57 137.56 6.66 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.87 -1.144 . . . . 0.0 110.69 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.456 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.28 4.8 42.05 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.309 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.659 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.05 -51.08 5.65 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.502 -1.374 . . . . 0.0 112.724 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.659 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.06 178.58 0.07 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.837 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.5 m-70 -140.03 158.66 43.71 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.191 -1.568 . . . . 0.0 114.798 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.31 159.28 25.32 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.58 176.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 48' ' ' LEU . 44.7 mt -52.86 156.25 2.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.055 -1.028 . . . . 0.0 112.32 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.617 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 7.3 ttp180 -63.18 -30.31 71.49 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.999 1.381 . . . . 0.0 108.956 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.277 0.7 OUTLIER -39.58 -61.55 0.8 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.97 -1.468 . . . . 0.0 112.277 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.775 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.5 m-20 -89.97 17.32 6.94 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.744 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.69 126.31 68.02 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.894 0 O-C-N 121.618 -0.676 . . . . 0.0 111.771 -178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -120.81 175.2 6.15 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.606 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 87.3 m-85 -124.41 150.16 45.92 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 120.993 -1.067 . . . . 0.0 111.478 -178.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.749 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -130.44 154.82 47.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.905 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.64 79.92 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.55 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -138.39 165.44 26.77 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 122.366 1.079 . . . . 0.0 110.427 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.04 -24.21 67.81 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.109 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.629 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.35 -36.25 71.45 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.736 -1.228 . . . . 0.0 109.081 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 26.6 tp10 -62.24 -49.1 77.07 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.726 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.32 -44.18 92.61 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.732 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.3 mt -60.55 -28.31 68.34 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.06 -17.99 54.24 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.634 -0.666 . . . . 0.0 110.017 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.65 0.39 20.42 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.014 0.911 . . . . 0.0 110.159 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.8 36.07 17.07 Favored Glycine 0 C--N 1.285 -2.264 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 21.3 m-85 -110.92 161.55 15.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.38 -1.071 . . . . 0.0 111.574 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -99.82 117.26 63.82 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.732 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.79 134.97 49.61 Favored 'Trans proline' 0 C--N 1.302 -1.87 0 O-C-N 123.499 1.263 . . . . 0.0 110.602 -178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.718 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.1 t -59.15 118.12 5.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.849 -0.532 . . . . 0.0 109.816 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -56.78 -0.17 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.457 -0.777 . . . . 0.0 111.618 -178.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.8 OUTLIER -104.71 -37.82 6.94 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 122.412 1.101 . . . . 0.0 108.096 179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.51 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 36.3 m -93.23 -16.18 25.07 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.904 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.632 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 42.4 tp60 -82.37 -46.44 0.95 Allowed Pre-proline 0 C--N 1.3 -1.564 0 O-C-N 121.426 -0.796 . . . . 0.0 112.089 -177.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 47.9 Cg_endo -74.51 -38.75 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 122.902 0.948 . . . . 0.0 111.361 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.01 178.08 5.89 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.996 -1.065 . . . . 0.0 109.534 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -114.22 140.26 48.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.219 -0.925 . . . . 0.0 111.719 -179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.4 -111.87 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -60.37 -30.51 7.27 Favored Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 119.484 -2.01 . . . . 0.0 108.11 176.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.3 Cg_endo -60.75 -16.98 47.26 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 N-CA-C 107.828 -1.643 . . . . 0.0 107.828 176.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.724 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.4 ttm180 -51.91 -63.36 1.16 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -50.7 -34.41 26.64 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.397 -0.814 . . . . 0.0 111.553 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -68.84 -42.34 77.29 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.143 -0.973 . . . . 0.0 109.161 -179.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -67.89 -23.6 65.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.092 -1.005 . . . . 0.0 108.869 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.64 -31.24 52.61 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 178.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.2 m-20 -63.19 -37.74 88.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -49.23 78.48 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.57 0.7 . . . . 0.0 109.693 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.875 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 12.5 mm -55.68 -43.91 75.07 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 121.085 -1.009 . . . . 0.0 110.531 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.3 m -51.09 -45.83 61.62 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.344 -1.473 . . . . 0.0 107.741 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.94 -36.02 64.84 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.658 ' HA ' ' OE1' ' A' ' 132' ' ' GLN . 13.1 t -62.25 -47.92 82.22 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 118.364 -1.335 . . . . 0.0 108.363 178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.6 ttm180 -50.6 -53.39 31.06 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.847 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.997 HD23 ' HB ' ' A' ' 101' ' ' THR . 5.7 tp -56.24 -39.75 73.05 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.369 -0.832 . . . . 0.0 111.292 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.812 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.9 OUTLIER -69.41 -10.23 57.04 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.574 0.702 . . . . 0.0 110.225 -178.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 4.0 tp10 -129.74 -4.97 4.63 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' A' ' 92' ' ' ARG . 18.4 tt0 -83.8 -54.85 4.6 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 121.268 -0.895 . . . . 0.0 109.736 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 1.117 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 4.4 pm0 -87.44 -155.66 0.3 Allowed 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.328 -1.349 . . . . 0.0 109.996 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.661 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.1 m -105.32 -61.15 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.249 -0.907 . . . . 0.0 108.77 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.661 ' HD2' ' H ' ' A' ' 98' ' ' THR . 38.6 Cg_endo -65.12 142.31 73.54 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 N-CA-C 107.797 -1.655 . . . . 0.0 107.797 173.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.746 HG12 HD11 ' A' ' 102' ' ' LEU . 10.7 t -76.5 149.28 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 120.256 -1.528 . . . . 0.0 110.022 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 1.117 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -115.86 104.11 11.31 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.026 0.917 . . . . 0.0 113.191 -176.294 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 116' ' ' LEU . 3.5 mp -131.09 -17.06 3.11 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -40.22 -45.77 2.12 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.332 -0.855 . . . . 0.0 112.901 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.39 -40.81 77.14 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.662 -1.274 . . . . 0.0 108.71 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 116' ' ' LEU . 2.4 tm? -69.14 -55.77 9.67 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.378 -0.826 . . . . 0.0 109.775 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -50.5 -43.62 55.75 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.284 -0.885 . . . . 0.0 110.761 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.17 -38.21 87.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tm0? -64.91 -40.33 94.91 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.822 . . . . 0.0 111.262 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.78 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.8 t -96.4 -15.17 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 120.877 -1.139 . . . . 0.0 111.38 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.78 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.67 35.9 0.15 Allowed 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.402 -0.811 . . . . 0.0 110.296 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 109' ' ' VAL . 21.0 ptt? -140.25 167.96 20.93 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.73 0.776 . . . . 0.0 111.755 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.498 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.5 p -73.19 170.86 12.11 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.814 -0.554 . . . . 0.0 111.824 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.619 ' CB ' HD22 ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.32 -32.58 72.52 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 O-C-N 123.764 1.402 . . . . 0.0 110.472 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.563 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 9.5 m-30 -69.54 -38.0 77.3 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.09 177.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.902 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 12.1 t-80 -70.78 -27.54 63.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 116.709 -1.996 . . . . 0.0 110.01 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.039 HD23 HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.71 -44.6 93.63 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 175.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.485 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -55.76 -48.26 75.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.433 HH12 ' H41' ' B' ' 203' ' ' ' DC' . 0.5 OUTLIER -54.82 -36.82 65.4 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.508 -0.745 . . . . 0.0 110.352 177.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.603 HD12 ' HE1' ' A' ' 111' ' ' MET . 0.3 OUTLIER -68.82 -46.19 69.23 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.89 -1.131 . . . . 0.0 108.362 177.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.875 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.278 0.2 OUTLIER -49.75 -40.25 40.39 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.906 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.771 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -74.63 -42.17 59.07 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.15 -0.969 . . . . 0.0 109.894 177.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.19 24.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.532 -0.73 . . . . 0.0 109.292 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.31 -60.47 2.32 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.622 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.875 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -49.17 -32.49 10.3 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.67 -1.269 . . . . 0.0 108.022 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.516 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.81 -40.02 2.69 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 118.216 -1.324 . . . . 0.0 114.189 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.516 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 17.0 mtm -159.49 48.93 0.31 Allowed 'General case' 0 N--CA 1.511 2.596 0 CA-C-N 122.634 3.217 . . . . 0.0 114.857 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.925 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.81 89.01 0.49 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 120.505 -1.372 . . . . 0.0 110.253 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.771 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 51.1 Cg_endo -70.16 -108.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 122.519 0.747 . . . . 0.0 113.049 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 1.085 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.19 -21.1 61.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.92 -1.113 . . . . 0.0 110.784 -178.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.545 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.9 -37.04 78.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.092 -1.005 . . . . 0.0 108.622 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.925 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.45 -37.48 87.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.755 -1.215 . . . . 0.0 107.883 177.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.812 ' OE1' HD22 ' A' ' 94' ' ' LEU . 11.3 tp60 -60.17 -47.62 85.17 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.62 -50.1 70.71 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.838 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.84 -60.0 4.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.191 -0.943 . . . . 0.0 110.359 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.565 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.251 0.1 OUTLIER -45.76 -49.03 15.32 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 121.932 0.872 . . . . 0.0 109.739 178.947 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.418 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 10.8 ttt-85 -60.35 -33.55 72.58 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.24 0.543 . . . . 0.0 110.417 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.03 -28.12 62.16 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.432 -0.792 . . . . 0.0 110.5 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -100.17 -15.81 18.01 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.47 -0.769 . . . . 0.0 109.44 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.036 -1.04 . . . . 0.0 110.056 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.33 1 C3'-C2'-C1' 114.792 8.637 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.565 3 C3'-C2'-C1' 113.723 7.873 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.489 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.829 1 C3'-C2'-C1' 114.911 8.722 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.508 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.25 2 C3'-C2'-C1' 114.944 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.508 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.707 2 C3'-C2'-C1' 114.535 8.454 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.583 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.031 2 C3'-C2'-C1' 114.241 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.621 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.107 8.148 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.621 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.114 2 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.458 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.997 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 1 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.584 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.05 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.902 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.671 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.599 1 C3'-C2'-C1' 114.526 8.447 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.573 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.65 2 C3'-C2'-C1' 114.909 8.721 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.519 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 2 C3'-C2'-C1' 115.749 9.321 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.652 2 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.52 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.876 2 C3'-C2'-C1' 114.846 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.514 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.706 8.576 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.432 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.145 2 C3'-C2'-C1' 114.347 8.319 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.578 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.19 2 C3'-C2'-C1' 114.626 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.578 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.028 2 C3'-C2'-C1' 114.594 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 1.085 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.291 1 C3'-C2'-C1' 114.876 8.697 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.495 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.086 1 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.536 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.536 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.162 1 C3'-C2'-C1' 115.213 8.938 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.473 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.693 8.566 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.45 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.587 1 C3'-C2'-C1' 114.815 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.544 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.079 1 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.622 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.622 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.224 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.718 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.403 -11.537 1 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.998 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.589 2 C3'-C2'-C1' 114.884 8.703 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.842 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.713 2 C3'-C2'-C1' 115.522 9.158 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.474 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.173 2 C3'-C2'-C1' 114.804 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.411 -10.726 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.497 2 C3'-C2'-C1' 114.223 8.231 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.222 0.534 . . . . 0.0 110.138 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.62 121.89 46.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.0 110.046 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -151.34 99.61 2.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 110.31 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.37 -154.84 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.163 -0.96 . . . . 0.0 109.274 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 9.0 t -72.5 45.34 0.13 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 110.384 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.548 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.8 OUTLIER 79.56 68.01 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -179.29 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.95 27.55 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.263 -0.898 . . . . 0.0 111.909 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.798 HG22 ' H ' ' A' ' 11' ' ' GLN . 72.1 m -80.04 64.41 4.86 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.786 -1.196 . . . . 0.0 107.928 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.575 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 21.6 p-10 -40.0 -31.07 0.1 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.338 0.589 . . . . 0.0 110.246 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -58.62 -52.84 63.95 Favored 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.399 -0.813 . . . . 0.0 109.753 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.798 ' H ' HG22 ' A' ' 8' ' ' THR . 0.4 OUTLIER -85.18 -29.17 24.96 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 117.246 -1.782 . . . . 0.0 109.893 178.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.5 mmt180 -52.75 -42.38 64.91 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.061 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 23.4 t-105 -63.84 -40.75 97.34 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.515 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -60.74 -29.71 69.55 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 118.279 -1.368 . . . . 0.0 107.343 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.02 -32.84 59.58 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 122.149 0.976 . . . . 0.0 108.77 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.4 t -72.15 -32.58 43.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-O 122.494 1.14 . . . . 0.0 111.25 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.061 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.256 1.5 mt -89.38 -32.29 17.36 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.259 1.028 . . . . 0.0 108.746 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.94 -11.6 60.01 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.716 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 46.3 mtm-85 63.84 40.32 7.63 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.295 -0.878 . . . . 0.0 109.322 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ASN . 37.9 t0 -70.09 110.16 6.17 Favored Pre-proline 0 C--N 1.301 -1.51 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.991 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.1 Cg_endo -70.3 6.43 1.5 Allowed 'Trans proline' 0 C--N 1.307 -1.608 0 O-C-N 123.757 1.398 . . . . 0.0 109.915 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.1 t30 -100.68 -11.38 20.02 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.996 0.903 . . . . 0.0 109.249 -178.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.858 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -108.78 -5.72 16.17 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.268 27.9 t0 -75.1 124.86 27.77 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.679 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -30.19 10.82 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 107.113 -2.395 . . . . 0.0 107.113 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 56' ' ' ALA . 19.5 tt0 -83.12 -44.55 14.99 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.689 -0.889 . . . . 0.0 109.822 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.858 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -146.43 170.44 16.84 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.383 1.087 . . . . 0.0 111.115 179.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.727 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -127.44 175.9 8.41 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.827 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -140.35 120.22 13.53 Favored 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 118.258 -1.377 . . . . 0.0 109.173 176.498 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.692 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.08 114.13 26.22 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.725 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.067 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.66 101.95 12.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.268 21.2 mtt180 -63.09 -20.07 65.01 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.931 0.872 . . . . 0.0 111.179 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.067 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.13 -31.33 72.47 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 121.812 0.815 . . . . 0.0 108.804 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.645 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -119.24 1.05 11.29 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.084 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 35.65 91.78 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.592 HG22 ' N ' ' A' ' 37' ' ' PHE . 70.2 mt -125.15 166.69 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.155 -1.203 . . . . 0.0 108.818 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.755 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -147.12 116.77 7.1 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 175.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.486 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.62 ' HD3' ' OD1' ' A' ' 24' ' ' ASP 0.274 13.1 mtt180 -87.46 177.82 2.52 Favored Pre-proline 0 C--N 1.289 -2.039 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.122 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.785 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 43.3 Cg_endo -70.2 -20.45 32.76 Favored 'Trans proline' 0 C--N 1.294 -2.311 0 O-C-N 123.248 1.13 . . . . 0.0 110.513 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.6 p -115.32 30.93 7.03 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.992 -1.067 . . . . 0.0 113.485 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 42.2 t -45.77 140.55 3.44 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.54 -1.35 . . . . 0.0 109.807 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.35 6.68 44.57 Favored 'General case' 0 C--N 1.287 -2.117 0 O-C-N 121.899 -0.5 . . . . 0.0 112.308 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.722 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.23 -51.01 5.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.562 -1.336 . . . . 0.0 112.338 -178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.876 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 1.3 ttp180 168.9 -173.35 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.939 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 5.3 m-70 -141.22 160.28 40.45 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.171 -1.58 . . . . 0.0 114.679 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.755 ' HA ' ' OP1' ' C' ' 235' ' ' ' DT' . . . -119.36 159.28 24.48 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.868 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.9 mt -53.17 159.29 1.31 Allowed 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.134 -0.979 . . . . 0.0 112.122 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.6 OUTLIER -65.64 -30.36 71.06 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.883 1.325 . . . . 0.0 108.749 178.883 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.279 0.7 OUTLIER -39.89 -62.1 0.76 Allowed 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.151 -179.807 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.79 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -90.08 17.29 7.1 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.681 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 133.43 57.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.566 0.698 . . . . 0.0 111.524 -178.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.827 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.2 p -126.35 175.29 7.95 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 88.2 m-85 -126.08 150.23 48.33 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.116 -0.99 . . . . 0.0 110.767 -178.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.727 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.3 m-85 -135.86 154.9 51.02 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.462 -179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.84 -39.76 76.22 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.6 p30 -139.09 164.33 30.06 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.553 1.168 . . . . 0.0 110.758 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.38 -23.42 67.4 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.106 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.612 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.5 t -70.86 -36.26 72.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.637 -1.289 . . . . 0.0 109.141 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 10.5 tp10 -62.5 -49.49 75.16 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 177.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.681 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.48 -43.07 93.34 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.3 mt -62.04 -27.82 69.15 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.23 -19.02 54.63 Favored 'General case' 0 C--N 1.312 -1.064 0 O-C-N 121.663 -0.648 . . . . 0.0 110.095 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.02 0.15 25.6 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.99 0.9 . . . . 0.0 110.54 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.61 39.09 9.92 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.7 m-85 -112.46 163.1 14.85 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.147 -1.208 . . . . 0.0 111.949 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -99.72 114.25 65.52 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.8 Cg_endo -63.07 132.57 37.21 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.55 1.29 . . . . 0.0 111.124 -178.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 6.8 t -59.95 112.13 1.74 Allowed 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 4.9 ttmt -52.78 -5.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.102 -0.999 . . . . 0.0 112.102 -177.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.522 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -98.79 -38.04 9.22 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.546 ' O ' ' NE ' ' A' ' 39' ' ' ARG . 56.1 m -95.17 0.18 53.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.557 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.706 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 4.2 tm0? -98.27 -54.74 0.19 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 120.814 -1.179 . . . . 0.0 111.907 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.706 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.0 Cg_endo -82.7 -14.52 8.93 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 122.92 0.958 . . . . 0.0 111.972 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.607 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 18.4 p-10 -74.83 178.49 5.47 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.121 -0.987 . . . . 0.0 111.25 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -107.45 114.79 29.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.423 -0.798 . . . . 0.0 111.412 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.736 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.43 -115.53 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.222 -0.924 . . . . 0.0 108.561 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.97 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -59.32 -30.05 6.96 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 119.792 -1.817 . . . . 0.0 108.603 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.97 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.3 Cg_endo -59.14 -15.76 30.04 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 N-CA-C 107.712 -1.688 . . . . 0.0 107.712 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 18.0 tpp85 -51.6 -63.55 1.1 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -49.65 -34.71 19.03 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.58 -0.7 . . . . 0.0 111.748 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.0 t60 -68.86 -41.4 78.46 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.123 -0.986 . . . . 0.0 108.884 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' HG12 ' A' ' 87' ' ' ILE . 0.9 OUTLIER -67.77 -24.41 65.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.062 -1.023 . . . . 0.0 108.663 177.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.985 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.55 -30.67 52.85 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 178.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.13 -37.55 83.23 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -57.79 -49.37 76.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.608 -0.683 . . . . 0.0 110.223 177.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.709 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -59.64 -39.45 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.766 -1.209 . . . . 0.0 110.273 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.87 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 26.3 m -52.24 -41.79 63.08 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.154 -1.591 . . . . 0.0 107.395 176.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -55.94 -41.31 74.45 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.98 -31.88 61.15 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.87 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.95 -53.32 57.38 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 96' ' ' GLN . 21.5 tpp180 -51.24 -54.49 25.33 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.104 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.585 HD23 ' OG1' ' A' ' 101' ' ' THR . 6.1 tp -56.17 -40.92 74.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.513 -0.742 . . . . 0.0 112.673 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.678 ' HG ' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.58 -10.76 59.5 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.511 -0.743 . . . . 0.0 111.292 -177.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.466 ' CG ' ' HB3' ' A' ' 139' ' ' ARG . 36.7 tp10 -129.95 -3.87 4.57 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.272 -0.892 . . . . 0.0 109.647 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 139' ' ' ARG . 8.0 tt0 -90.13 -55.95 3.41 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.393 -0.817 . . . . 0.0 109.793 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.644 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.64 -155.47 0.3 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.157 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.541 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 m -105.19 -66.63 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.878 0 O-C-N 120.958 -1.089 . . . . 0.0 111.537 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.644 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 39.7 Cg_endo -65.36 140.56 64.39 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 O-C-N 122.691 0.837 . . . . 0.0 110.075 178.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.767 HG12 ' CD1' ' A' ' 102' ' ' LEU . 2.8 t -77.56 144.32 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.177 -1.577 . . . . 0.0 109.43 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.814 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -117.31 99.1 6.79 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.707 1.242 . . . . 0.0 113.452 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.866 HD23 HD12 ' A' ' 116' ' ' LEU . 7.0 mp -131.26 -4.4 3.85 Favored 'General case' 0 C--N 1.288 -2.107 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -40.43 -45.4 2.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.68 -0.638 . . . . 0.0 112.263 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.32 71.61 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.162 -1.415 . . . . 0.0 108.698 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 116' ' ' LEU . 6.4 mt -68.68 -54.64 15.01 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.593 -0.692 . . . . 0.0 110.161 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.32 -38.83 69.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.109 -0.995 . . . . 0.0 109.626 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -42.01 97.75 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.515 0.674 . . . . 0.0 109.401 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -64.68 -56.57 12.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.491 -0.756 . . . . 0.0 109.924 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 61.9 t -64.22 -19.98 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.363 -0.836 . . . . 0.0 109.921 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 14.41 0.96 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.782 -0.574 . . . . 0.0 111.098 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.744 ' SD ' ' HB2' ' A' ' 115' ' ' HIS . 2.8 ptm -141.35 -164.58 1.79 Allowed 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.443 -1.303 . . . . 0.0 112.93 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.543 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.0 OUTLIER -68.98 170.54 8.38 Favored Pre-proline 0 N--CA 1.509 2.481 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -176.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.543 ' HD2' ' CB ' ' A' ' 112' ' ' SER . 37.7 Cg_endo -61.05 -26.71 83.4 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 124.789 3.659 . . . . 0.0 110.796 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.557 ' CZ ' ' OP2' ' C' ' 223' ' ' ' DT' . 11.4 m-30 -67.44 -37.35 82.87 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.915 -1.514 . . . . 0.0 108.968 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.775 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 6.1 t60 -71.01 -31.61 68.18 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 116.18 -2.208 . . . . 0.0 109.915 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.866 HD12 HD23 ' A' ' 102' ' ' LEU . 1.4 tm? -56.77 -45.43 82.09 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 25.9 m170 -57.55 -47.53 81.78 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.412 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.8 OUTLIER -54.9 -37.36 66.24 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.726 -0.609 . . . . 0.0 110.014 177.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.64 ' C ' HD13 ' A' ' 119' ' ' LEU . 3.4 tm? -68.77 -47.34 66.45 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.888 -1.132 . . . . 0.0 109.15 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.694 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.74 -38.86 35.46 Favored 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.743 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.1 tttm -75.16 -39.57 60.24 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.934 -1.104 . . . . 0.0 110.018 177.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.55 -55.34 36.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.42 -0.8 . . . . 0.0 109.001 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.985 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.35 -60.49 2.31 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.295 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.736 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.1 -32.88 37.1 Favored 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.704 -1.248 . . . . 0.0 108.626 177.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.533 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.64 -36.68 4.12 Favored Glycine 0 N--CA 1.494 2.566 0 CA-C-O 117.954 -1.47 . . . . 0.0 114.824 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.6 ' O ' ' OG1' ' A' ' 127' ' ' THR . 8.1 mtt -160.56 49.47 0.26 Allowed 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 123.064 3.432 . . . . 0.0 115.597 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.712 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 61.6 m -170.38 78.66 0.6 Allowed Pre-proline 0 N--CA 1.496 1.849 0 O-C-N 120.097 -1.627 . . . . 0.0 111.241 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.743 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 53.7 Cg_endo -72.26 -106.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 122.28 0.621 . . . . 0.0 113.178 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 1.05 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 13.0 tptm -60.21 -21.87 62.31 Favored 'General case' 0 C--N 1.309 -1.165 0 O-C-N 121.102 -0.999 . . . . 0.0 110.757 -178.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.555 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -31.38 70.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.688 -1.257 . . . . 0.0 107.927 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.749 ' CE3' ' HA ' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -64.3 -41.99 96.59 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 177.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.722 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 24.4 tm0? -55.4 -36.42 66.42 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.72 -48.5 69.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.518 -0.739 . . . . 0.0 109.553 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.51 82.26 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.25 -0.906 . . . . 0.0 108.967 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.722 ' CD1' ' HA ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -53.88 -51.74 62.7 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.453 1.121 . . . . 0.0 108.233 177.567 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 22.3 ttm180 -62.28 -24.13 67.11 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.144 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.86 -40.21 28.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.299 -0.876 . . . . 0.0 111.049 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -84.24 -23.15 30.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 0.0 109.442 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.491 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 5.3 ttt-85 . . . . . 0 N--CA 1.489 1.507 0 O-C-N 120.813 -1.18 . . . . 0.0 109.914 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.514 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.263 1 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.514 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.673 3 C3'-C2'-C1' 113.674 7.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.453 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.983 1 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.476 ' C2 ' ' C5 ' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.258 2 C3'-C2'-C1' 114.871 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.945 2 C3'-C2'-C1' 114.924 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.836 2 C3'-C2'-C1' 114.224 8.232 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.554 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.408 -10.974 1 C3'-C2'-C1' 114.388 8.349 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.544 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.059 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.546 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.57 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.735 1 C3'-C2'-C1' 115.162 8.901 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.599 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.262 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.775 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.408 -11.003 1 C3'-C2'-C1' 114.584 8.489 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.699 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.887 1 C3'-C2'-C1' 114.678 8.556 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.589 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.571 2 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.541 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.247 2 C3'-C2'-C1' 115.795 9.354 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.541 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.649 2 C3'-C2'-C1' 114.893 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.528 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.807 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.463 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.195 2 C3'-C2'-C1' 114.258 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.587 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.305 2 C3'-C2'-C1' 114.568 8.477 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.587 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.316 2 C3'-C2'-C1' 114.57 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 1.05 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.433 1 C3'-C2'-C1' 115.07 8.835 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.521 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.934 1 C3'-C2'-C1' 114.921 8.729 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.521 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.066 2 C3'-C2'-C1' 114.521 8.443 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.516 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.11 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.516 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.759 2 C3'-C2'-C1' 114.686 8.561 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.524 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.336 1 C3'-C2'-C1' 114.881 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.546 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.175 2 C3'-C2'-C1' 114.61 8.507 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.652 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.078 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.652 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.144 8.889 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.631 " H1'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.407 -11.079 1 C3'-C2'-C1' 114.9 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.876 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.413 -10.465 2 C3'-C2'-C1' 114.321 8.301 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.939 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.696 2 C3'-C2'-C1' 115.534 9.167 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.518 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.419 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.416 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.823 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.416 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.437 2 C3'-C2'-C1' 114.318 8.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.729 0.3 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -121.5 -25.33 5.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.855 -1.153 . . . . 0.0 110.822 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -167.45 133.63 2.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.995 -1.065 . . . . 0.0 110.488 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -82.17 -154.91 0.13 Allowed 'General case' 0 N--CA 1.484 1.229 0 O-C-N 121.203 -0.936 . . . . 0.0 108.78 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.723 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.8 m -73.58 41.25 0.11 Allowed 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.103 . . . . 0.0 110.087 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 5' ' ' THR . 90.2 m 79.36 51.83 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 120.993 0.425 . . . . 0.0 110.216 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.589 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -148.17 0.4 0.61 Allowed 'General case' 0 C--N 1.308 -1.212 0 O-C-N 121.236 -0.915 . . . . 0.0 111.886 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.776 HG22 ' H ' ' A' ' 11' ' ' GLN . 94.0 m -81.67 67.89 7.81 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 120.872 -1.142 . . . . 0.0 108.101 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.6 p30 -38.94 -32.24 0.08 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.708 -0.62 . . . . 0.0 110.928 -178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 1.0 OUTLIER -60.15 -55.06 38.51 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.136 -0.977 . . . . 0.0 109.316 177.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.776 ' H ' HG22 ' A' ' 8' ' ' THR . 1.0 OUTLIER -77.77 -23.13 49.29 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 117.532 -1.667 . . . . 0.0 108.895 178.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.869 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -56.01 -41.65 75.22 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 177.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.9 t-105 -62.09 -40.88 97.32 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.579 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 7.3 tp-100 -61.37 -30.13 70.34 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 177.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 -34.48 66.69 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-O 122.247 1.023 . . . . 0.0 108.437 177.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.869 HG23 ' O ' ' A' ' 12' ' ' ARG . 45.9 t -70.53 -34.56 57.95 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 CA-C-O 122.373 1.082 . . . . 0.0 111.254 -179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.3 mt -89.04 -31.73 17.93 Favored 'General case' 0 C--N 1.262 -3.225 0 CA-C-O 122.237 1.018 . . . . 0.0 108.886 -179.421 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.97 -9.85 59.72 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.452 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.649 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 66.09 40.72 3.85 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.094 -1.003 . . . . 0.0 109.296 -179.516 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -70.09 110.11 6.08 Favored Pre-proline 0 C--N 1.299 -1.626 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.051 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -74.28 6.27 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 O-C-N 123.621 1.327 . . . . 0.0 109.31 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.1 t30 -100.23 -11.69 20.17 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.981 0.896 . . . . 0.0 109.156 -178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.25 -5.64 15.23 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.851 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 27.9 t0 -75.8 126.29 30.73 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.762 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.83 -23.24 36.38 Favored Glycine 0 N--CA 1.505 3.294 0 N-CA-C 106.87 -2.492 . . . . 0.0 106.87 -176.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' ' HB3' ' A' ' 6' ' ' CYS . 10.5 tp10 -89.86 -50.83 5.81 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 121.736 -0.861 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.824 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.5 p90 -140.76 170.56 15.53 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.52 1.152 . . . . 0.0 111.618 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.769 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.81 175.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.81 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.92 121.82 14.5 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 118.334 -1.346 . . . . 0.0 109.238 176.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.34 115.47 30.04 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.983 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.15 113.99 27.15 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.266 54.3 mtm180 -70.1 -20.3 63.2 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.951 0.881 . . . . 0.0 111.23 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.983 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.74 -31.48 72.16 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-O 121.787 0.804 . . . . 0.0 109.212 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.775 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.6 t -117.78 -0.69 11.71 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.187 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.04 34.85 89.49 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.016 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 70.6 mt -125.11 166.04 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.23 -1.159 . . . . 0.0 109.346 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.76 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.8 p90 -144.31 117.33 8.86 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.496 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.941 ' HD3' ' HB2' ' A' ' 77' ' ' ALA 0.261 6.0 mtt180 -88.8 176.85 2.91 Favored Pre-proline 0 C--N 1.284 -2.274 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.735 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.1 Cg_endo -68.84 -19.21 41.03 Favored 'Trans proline' 0 C--N 1.292 -2.438 0 O-C-N 123.239 1.126 . . . . 0.0 111.944 -178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.649 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 52.0 p -115.18 31.02 6.97 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.603 -1.31 . . . . 0.0 112.942 -177.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.485 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -48.76 136.15 14.07 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.706 -1.246 . . . . 0.0 110.733 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.688 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 2.4 ptp180 -101.23 5.76 42.69 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.406 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.632 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.93 5.71 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.344 -1.473 . . . . 0.0 113.06 -177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER 173.76 175.1 0.14 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.808 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.3 m-70 -140.23 159.2 42.71 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.136 -1.602 . . . . 0.0 114.552 -178.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.725 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.27 162.76 18.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.969 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.4 mt -55.98 159.74 3.12 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.148 -0.97 . . . . 0.0 112.092 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 0.4 OUTLIER -65.32 -30.24 71.07 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 122.94 1.352 . . . . 0.0 109.038 178.879 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.8 OUTLIER -38.66 -62.55 0.6 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.125 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.764 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.4 m-20 -90.13 17.1 7.36 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.718 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -110.76 128.57 67.05 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 O-C-N 121.541 -0.724 . . . . 0.0 111.488 -178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.6 p -124.32 175.17 7.25 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 93.5 m-85 -121.42 150.28 41.76 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.086 -1.009 . . . . 0.0 111.768 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.769 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.7 m-85 -132.12 154.86 49.06 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.704 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.96 -39.79 72.34 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 7.1 p30 -138.03 164.5 28.93 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.586 1.184 . . . . 0.0 110.515 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.761 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -62.75 -25.4 68.18 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.268 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.7 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -69.6 -37.67 76.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.669 -1.269 . . . . 0.0 109.22 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -60.64 -48.95 79.48 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 177.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.748 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.23 -44.33 92.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.158 0.98 . . . . 0.0 108.446 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 75.5 mt -60.42 -28.36 68.2 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.19 -18.54 55.36 Favored 'General case' 0 C--N 1.312 -1.06 0 O-C-N 121.612 -0.68 . . . . 0.0 110.111 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.13 0.18 22.58 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 122.011 0.91 . . . . 0.0 110.642 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.67 38.9 11.21 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.418 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 12.5 m-85 -113.73 161.71 17.17 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -1.071 . . . . 0.0 111.626 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.82 115.58 65.46 Favored Pre-proline 0 C--N 1.301 -1.524 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.728 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.0 Cg_endo -61.77 135.55 56.81 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.521 1.274 . . . . 0.0 110.972 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.798 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 5.4 t -62.2 117.99 6.79 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 109.74 -178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.554 ' HB3' H5'' ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -55.88 -2.98 0.06 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.388 -0.82 . . . . 0.0 111.409 -179.291 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.459 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.1 OUTLIER -102.01 -37.67 8.1 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.552 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 77.9 m -98.04 0.29 45.94 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.531 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.631 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -98.36 -47.9 0.22 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.147 -0.97 . . . . 0.0 111.565 -178.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.1 Cg_endo -85.81 -20.74 2.92 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 122.823 0.907 . . . . 0.0 111.923 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 13.0 p-10 -74.8 178.47 5.47 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.894 -1.128 . . . . 0.0 110.67 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 17.0 mmtm -112.07 134.87 53.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.283 -0.886 . . . . 0.0 111.035 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.941 ' HB2' ' HD3' ' A' ' 39' ' ' ARG . . . -92.75 -121.17 0.09 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.592 -0.692 . . . . 0.0 109.544 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -58.11 -30.7 8.28 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 119.788 -1.82 . . . . 0.0 108.672 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.5 Cg_endo -62.06 -18.75 63.44 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 N-CA-C 107.776 -1.663 . . . . 0.0 107.776 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -46.78 -69.31 0.13 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.646 0.736 . . . . 0.0 109.856 178.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -49.19 -34.86 15.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.647 -0.658 . . . . 0.0 112.246 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -69.52 -45.87 67.85 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.974 -1.079 . . . . 0.0 110.061 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -67.48 -23.83 65.53 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.017 -1.052 . . . . 0.0 108.918 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.93 HD21 HG22 ' A' ' 123' ' ' THR . 1.2 mm? -78.19 -31.46 49.51 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.571 -1.251 . . . . 0.0 108.697 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.56 -37.63 81.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.52 -51.41 69.97 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.911 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.798 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -60.01 -37.26 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.805 -1.185 . . . . 0.0 110.63 -179.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 34.3 m -54.43 -45.17 72.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.119 -1.613 . . . . 0.0 107.349 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.404 ' HA ' ' NH1' ' A' ' 92' ' ' ARG . 1.6 t-80 -56.23 -36.95 69.06 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.81 -40.06 69.14 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 47.7 t -62.38 -47.86 82.29 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 117.732 -1.587 . . . . 0.0 108.836 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 96' ' ' GLN . 6.3 ttm105 -47.72 -54.48 12.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.332 -0.855 . . . . 0.0 109.748 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.436 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 0.8 OUTLIER -56.16 -36.4 68.28 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.473 -0.767 . . . . 0.0 111.109 179.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.768 ' HG ' HG12 ' A' ' 100' ' ' VAL 0.253 0.2 OUTLIER -68.68 -10.59 57.16 Favored 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.465 0.65 . . . . 0.0 110.13 -178.391 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 34.8 tp10 -131.44 -9.04 3.69 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.546 -0.721 . . . . 0.0 109.844 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' A' ' 92' ' ' ARG . 38.1 tt0 -78.86 -48.52 14.52 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.323 -0.861 . . . . 0.0 109.603 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 6.3 pt-20 -87.22 -155.42 0.28 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.705 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.579 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.3 m -98.54 -62.93 0.1 OUTLIER Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.185 -0.947 . . . . 0.0 108.567 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.579 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.51 141.26 66.52 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 N-CA-C 108.117 -1.532 . . . . 0.0 108.117 175.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.768 HG12 ' HG ' ' A' ' 94' ' ' LEU . 6.1 t -77.33 149.81 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 120.34 -1.475 . . . . 0.0 108.973 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.457 ' H ' ' HA ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -109.84 98.06 7.45 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 123.565 1.65 . . . . 0.0 112.885 -177.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.877 HD21 HD12 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -132.53 -33.96 1.22 Allowed 'General case' 0 C--N 1.28 -2.442 0 N-CA-C 103.913 -2.625 . . . . 0.0 103.913 176.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.428 ' H ' ' H ' ' A' ' 102' ' ' LEU . 1.5 tm-20 -35.05 -46.1 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.026 -0.988 . . . . 0.0 113.283 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.37 72.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.184 -1.572 . . . . 0.0 109.688 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.926 HD23 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.78 -40.43 76.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.266 -0.896 . . . . 0.0 109.728 179.724 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.23 -37.43 80.81 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.309 -0.869 . . . . 0.0 109.41 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.94 -37.86 88.97 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.408 0.623 . . . . 0.0 109.464 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -66.66 -49.55 65.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.513 -0.742 . . . . 0.0 109.955 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.743 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 46.3 t -71.0 -17.38 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.367 -0.833 . . . . 0.0 110.482 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.6 21.79 0.57 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.592 -0.693 . . . . 0.0 110.785 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.719 ' CE ' ' HB3' ' A' ' 115' ' ' HIS . 1.4 ppp? -140.55 -175.08 4.14 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.391 -0.924 . . . . 0.0 111.944 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.685 ' O ' ' CE ' ' A' ' 111' ' ' MET . 0.8 OUTLIER -73.48 170.01 15.91 Favored Pre-proline 0 N--CA 1.51 2.562 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 112' ' ' SER . 41.0 Cg_endo -65.96 -27.97 50.29 Favored 'Trans proline' 0 N--CA 1.487 1.129 0 C-N-CA 123.096 2.531 . . . . 0.0 112.18 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.569 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 9.8 m-30 -68.13 -45.76 72.72 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 118.201 -1.4 . . . . 0.0 110.769 -178.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.868 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 7.5 t-80 -70.84 -20.99 62.49 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 115.138 -2.625 . . . . 0.0 111.053 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.926 HD21 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -66.9 -37.57 84.64 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 176.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.602 ' NE2' HD23 ' A' ' 102' ' ' LEU . 32.9 m170 -67.36 -36.16 80.82 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -63.46 -32.8 74.34 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.336 -0.853 . . . . 0.0 108.976 176.616 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.56 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.1 tm? -70.09 -44.81 68.3 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.108 -0.995 . . . . 0.0 108.468 176.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.675 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.3 OUTLIER -49.63 -40.35 39.02 Favored 'General case' 0 N--CA 1.521 3.106 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.996 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.79 ' HB2' ' N ' ' A' ' 128' ' ' PRO 0.269 9.2 tptp -69.77 -45.47 67.97 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 121.713 0.768 . . . . 0.0 111.034 176.548 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.42 -53.02 62.99 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.408 0.623 . . . . 0.0 109.867 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.93 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.85 -59.07 3.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.502 -0.749 . . . . 0.0 109.71 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.826 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.5 t -51.52 -33.03 29.98 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.764 -1.21 . . . . 0.0 108.356 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.469 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.37 -40.23 2.62 Favored Glycine 0 N--CA 1.492 2.432 0 CA-C-O 118.205 -1.331 . . . . 0.0 114.017 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.646 ' HA ' ' CD ' ' A' ' 121' ' ' LYS . 2.5 mtt -157.36 48.95 0.43 Allowed 'General case' 0 N--CA 1.511 2.601 0 CA-C-N 122.482 3.141 . . . . 0.0 115.21 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.056 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.95 83.9 0.51 Allowed Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.261 -1.524 . . . . 0.0 111.365 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.79 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.4 Cg_endo -71.65 -108.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 122.244 0.602 . . . . 0.0 113.544 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.732 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -59.19 -21.75 59.93 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.238 -0.914 . . . . 0.0 110.782 -178.208 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.529 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.41 -37.6 77.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.041 -1.037 . . . . 0.0 109.292 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.056 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.14 -33.89 76.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.723 -1.236 . . . . 0.0 107.778 177.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.756 ' NE2' HD22 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -67.86 -47.97 67.44 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 109.377 177.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -62.21 -43.54 98.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.16 -0.962 . . . . 0.0 111.103 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -65.96 -60.15 3.13 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.086 -1.008 . . . . 0.0 110.914 -178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.826 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.55 -48.78 19.37 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.406 -0.809 . . . . 0.0 109.961 179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.463 ' HG3' ' HB2' ' A' ' 95' ' ' GLU . 12.5 ttt180 -59.17 -37.69 77.96 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.652 -0.655 . . . . 0.0 109.557 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -63.31 -32.51 73.95 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.523 -0.735 . . . . 0.0 110.08 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -88.59 -22.59 23.43 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.986 -1.006 . . . . 0.0 110.184 178.679 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.531 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.218 1 C3'-C2'-C1' 114.751 8.608 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.635 2 C3'-C2'-C1' 113.701 7.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.462 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.808 1 C3'-C2'-C1' 114.928 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.522 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 2 C3'-C2'-C1' 114.983 8.774 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.522 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.632 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.42 -9.813 2 C3'-C2'-C1' 114.263 8.26 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.632 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.412 -10.645 2 C3'-C2'-C1' 114.168 8.191 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.616 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.688 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.914 2 C3'-C2'-C1' 114.69 8.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.611 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.408 -11.04 1 C3'-C2'-C1' 115.301 9.001 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.611 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.245 2 C3'-C2'-C1' 114.696 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.868 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.774 1 C3'-C2'-C1' 114.845 8.675 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.719 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.622 1 C3'-C2'-C1' 114.548 8.463 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.563 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.83 2 C3'-C2'-C1' 114.953 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.568 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 115.626 9.233 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.568 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.71 2 C3'-C2'-C1' 114.896 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.506 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.93 2 C3'-C2'-C1' 114.899 8.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.506 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.428 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.074 2 C3'-C2'-C1' 114.357 8.327 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.702 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.184 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.702 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.545 8.461 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.732 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -9.996 2 C3'-C2'-C1' 114.941 8.743 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.591 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.953 1 C3'-C2'-C1' 115.134 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.054 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.499 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.326 1 C3'-C2'-C1' 115.184 8.917 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.499 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.904 2 C3'-C2'-C1' 114.739 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.547 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.592 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.073 1 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.63 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.214 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.63 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.154 2 C3'-C2'-C1' 115.148 8.891 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.798 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 1.016 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.408 -11.01 2 C3'-C2'-C1' 114.648 8.534 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.815 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.508 2 C3'-C2'-C1' 115.575 9.197 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.447 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.482 2 C3'-C2'-C1' 114.874 8.696 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.422 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.733 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.422 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.302 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 mtm . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 132.27 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.105 -0.997 . . . . 0.0 111.165 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.99 -129.98 0.29 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -107.04 -154.34 0.52 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.521 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 t -63.67 22.84 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.843 -1.161 . . . . 0.0 108.938 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.747 ' H ' ' C ' ' A' ' 4' ' ' ALA . 1.1 t 79.74 -154.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -178.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.741 ' HG ' ' C ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER 68.46 -14.98 0.24 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.099 -1.001 . . . . 0.0 111.395 178.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.758 ' O ' ' HD2' ' A' ' 12' ' ' ARG . 20.9 m -79.84 63.6 4.44 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.817 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.6 p-10 -45.75 -30.25 1.56 Allowed 'General case' 0 N--CA 1.506 2.325 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.114 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -55.19 -44.83 75.64 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.597 ' H ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -80.81 -26.07 37.37 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 117.894 -1.523 . . . . 0.0 109.341 177.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -54.7 -42.18 71.16 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 176.131 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.058 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 33.7 t-105 -62.95 -40.83 98.85 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.573 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.46 -31.29 71.24 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.304 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.468 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -70.73 -31.71 68.65 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.527 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 47.7 t -73.46 -35.18 44.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-O 122.258 1.028 . . . . 0.0 111.664 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.058 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.262 2.0 mt -90.3 -32.04 16.69 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-O 122.275 1.036 . . . . 0.0 109.096 -179.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.19 -12.96 59.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.01 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.724 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 14.3 mtt180 68.45 41.33 1.8 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.088 -1.007 . . . . 0.0 109.579 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.27 109.94 5.85 Favored Pre-proline 0 C--N 1.301 -1.506 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.8 Cg_endo -70.75 6.24 1.73 Allowed 'Trans proline' 0 C--N 1.309 -1.539 0 O-C-N 123.716 1.377 . . . . 0.0 110.097 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.3 1.3 t30 -104.38 -11.49 17.09 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.986 0.898 . . . . 0.0 109.334 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.852 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.1 -5.9 15.26 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.923 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.282 29.5 t0 -77.09 123.2 26.04 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 179.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.772 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.94 -34.44 5.62 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 107.034 -2.426 . . . . 0.0 107.034 -177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 56' ' ' ALA . 17.8 tp10 -76.44 -41.35 47.76 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 121.78 -0.835 . . . . 0.0 108.855 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.852 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -149.8 170.36 18.94 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.321 1.058 . . . . 0.0 110.734 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -129.32 175.88 9.55 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 177.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.805 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -137.97 120.04 15.56 Favored 'General case' 0 C--N 1.279 -2.474 0 C-N-CA 117.963 -1.495 . . . . 0.0 108.946 176.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -97.84 113.53 25.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.635 -1.166 . . . . 0.0 113.259 -175.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.016 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.97 102.58 12.73 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.277 45.2 mtm180 -63.96 -19.92 65.5 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.011 0.91 . . . . 0.0 111.214 -178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.016 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.0 -31.79 72.58 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 121.729 0.776 . . . . 0.0 109.292 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.596 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.8 t -118.84 5.49 11.47 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.73 -0.788 . . . . 0.0 110.718 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.27 34.72 81.48 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 37' ' ' PHE . 66.4 mt -124.78 164.76 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.276 -1.132 . . . . 0.0 109.563 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.0 p90 -148.23 118.12 7.16 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.483 ' SG ' ' CB ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.664 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.279 1.1 mtp180 -84.54 172.43 9.03 Favored Pre-proline 0 C--N 1.279 -2.481 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 177.4 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.797 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -68.91 -13.39 36.64 Favored 'Trans proline' 0 C--N 1.286 -2.746 0 O-C-N 123.437 1.23 . . . . 0.0 110.564 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.21 30.74 7.16 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.778 -1.201 . . . . 0.0 112.77 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 41.8 t -52.33 133.52 34.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.69 -1.256 . . . . 0.0 108.985 178.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.417 ' HD3' " H4'" ' B' ' 199' ' ' ' DA' . 6.3 ptp180 -101.05 5.26 42.91 Favored 'General case' 0 C--N 1.285 -2.236 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.239 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.751 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.4 -50.92 5.68 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.148 -1.421 . . . . 0.0 112.614 -178.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.639 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 174.97 180.0 0.12 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.833 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.3 m-70 -140.21 160.17 40.54 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.175 -1.578 . . . . 0.0 115.049 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.771 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.75 160.54 19.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.089 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.81 160.38 1.93 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.106 -0.996 . . . . 0.0 112.259 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.8 OUTLIER -70.27 -30.51 67.56 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.851 1.31 . . . . 0.0 108.737 178.994 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.278 0.8 OUTLIER -40.4 -61.86 0.85 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.057 -1.429 . . . . 0.0 111.991 -179.87 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.9 m-20 -89.98 17.22 7.05 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.761 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.43 126.05 70.81 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 CA-C-O 121.482 0.658 . . . . 0.0 111.586 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.805 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 4.3 p -125.43 175.23 7.64 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.2 m-85 -117.25 150.21 39.16 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.292 1.044 . . . . 0.0 112.39 -177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.788 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.7 m-85 -129.11 154.84 46.31 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.976 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.4 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.06 -39.84 78.88 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 178.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.8 165.79 26.36 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 122.471 1.129 . . . . 0.0 110.698 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.715 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.86 -22.82 66.56 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.306 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -72.19 -36.32 69.21 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.573 -1.329 . . . . 0.0 108.861 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 17.0 tp10 -62.23 -48.7 78.81 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.689 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -44.43 92.69 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 177.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.0 mt -60.53 -28.83 68.71 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.15 -16.52 54.73 Favored 'General case' 0 C--N 1.311 -1.071 0 O-C-N 121.696 -0.628 . . . . 0.0 110.197 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.554 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.24 0.5 21.74 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.265 -0.897 . . . . 0.0 110.226 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.95 39.0 10.59 Favored Glycine 0 C--N 1.285 -2.254 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.6 m-85 -114.79 159.84 20.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.438 -1.036 . . . . 0.0 111.24 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.5 mmt-85 -99.89 117.89 62.66 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.697 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.8 131.3 32.59 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.512 1.27 . . . . 0.0 110.4 -178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.738 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.8 t -53.27 119.65 5.03 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.487 0.66 . . . . 0.0 110.525 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.534 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.6 ttpt -50.12 -9.77 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.533 -0.729 . . . . 0.0 111.743 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -97.67 -41.53 8.06 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.239 1.018 . . . . 0.0 108.653 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 93.5 m -94.96 -2.49 50.36 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.372 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 34.7 tt0 -90.63 -42.91 0.4 Allowed Pre-proline 0 C--N 1.301 -1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 111.864 -177.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 52.0 Cg_endo -81.62 -30.82 1.31 Allowed 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 122.897 0.946 . . . . 0.0 111.361 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.664 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 59.0 p30 -84.44 178.09 7.87 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.077 -1.015 . . . . 0.0 111.287 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 12.9 mttm -112.4 140.51 47.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.398 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.772 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -85.05 -106.36 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.663 -0.648 . . . . 0.0 109.871 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.003 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.7 m120 -60.49 -30.81 7.67 Favored Pre-proline 0 N--CA 1.501 2.09 0 O-C-N 119.43 -2.044 . . . . 0.0 107.561 176.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.003 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -60.28 -17.8 48.76 Favored 'Trans proline' 0 CA--C 1.55 1.318 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 176.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -57.84 -64.41 0.91 Allowed 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.509 -0.745 . . . . 0.0 109.218 178.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -50.5 -34.33 24.73 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.298 -0.876 . . . . 0.0 111.512 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 5.8 m-70 -68.84 -38.86 80.1 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.145 -0.972 . . . . 0.0 108.978 -179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -69.01 -26.19 64.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.02 -1.05 . . . . 0.0 108.629 177.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 123' ' ' THR . 1.5 mm? -77.5 -29.61 52.63 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.5 OUTLIER -60.84 -37.47 82.17 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 89' ' ' HIS . 9.3 ttpp -55.79 -49.14 74.02 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.532 -0.73 . . . . 0.0 109.812 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.851 HD12 HD13 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -56.75 -40.4 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.746 0 O-C-N 120.728 -1.232 . . . . 0.0 110.311 179.138 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.955 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 22.4 m -52.5 -41.8 63.72 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 119.984 -1.698 . . . . 0.0 107.682 176.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.489 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 66.2 t-80 -57.54 -38.95 75.59 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 176.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.747 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.76 -31.64 58.88 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 176.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.955 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.69 -57.38 12.21 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.43 ' NH2' ' NE2' ' A' ' 89' ' ' HIS . 42.1 ttp180 -49.93 -54.79 17.52 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.752 HD21 ' OE1' ' A' ' 97' ' ' GLU . 2.2 tm? -56.28 -37.49 69.92 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.478 -0.764 . . . . 0.0 112.427 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.838 ' CD1' HG13 ' A' ' 100' ' ' VAL . 2.2 mp -69.3 -10.59 58.55 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.313 0.578 . . . . 0.0 110.312 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.504 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 5.8 tp10 -129.39 -5.55 4.79 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.194 177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' ARG . 36.0 tt0 -90.04 -65.48 1.01 Allowed 'General case' 0 C--N 1.309 -1.191 0 O-C-N 121.24 -0.912 . . . . 0.0 109.662 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.752 ' OE1' HD21 ' A' ' 93' ' ' LEU . 21.2 pt-20 -88.45 -155.34 0.32 Allowed 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.892 -1.123 . . . . 0.0 110.752 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.604 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.39 -60.52 0.05 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.518 -0.739 . . . . 0.0 109.992 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 98' ' ' THR . 37.2 Cg_endo -63.26 130.77 29.72 Favored 'Trans proline' 0 C--N 1.303 -1.86 0 N-CA-C 106.161 -2.284 . . . . 0.0 106.161 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.849 ' CG1' HD13 ' A' ' 102' ' ' LEU 0.274 2.5 t -77.95 165.64 2.95 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.734 ' OG1' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.91 95.96 6.0 Favored 'General case' 0 CA--C 1.49 -1.349 0 C-N-CA 115.881 -2.328 . . . . 0.0 106.628 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.849 HD13 ' CG1' ' A' ' 100' ' ' VAL . 1.9 mp -133.2 -32.71 1.17 Allowed 'General case' 0 C--N 1.256 -3.49 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -40.04 -46.06 2.05 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.39 69.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.391 -1.443 . . . . 0.0 108.659 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -66.31 -57.48 7.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.785 -0.572 . . . . 0.0 109.752 179.154 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -54.54 -40.04 68.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.494 -0.754 . . . . 0.0 110.579 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -39.24 93.43 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.439 -0.788 . . . . 0.0 110.3 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -66.22 -41.91 89.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.298 -0.876 . . . . 0.0 110.699 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 3.4 t -87.5 -21.85 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.043 -1.035 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.76 39.28 0.1 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.685 -0.634 . . . . 0.0 110.364 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.756 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.86 166.93 22.16 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.975 -1.078 . . . . 0.0 112.46 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.17 171.01 11.5 Favored Pre-proline 0 N--CA 1.506 2.336 0 O-C-N 121.867 -0.521 . . . . 0.0 111.995 -179.025 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.3 Cg_endo -61.46 -34.7 85.53 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 O-C-N 123.8 1.421 . . . . 0.0 111.675 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.634 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 12.1 m-30 -69.43 -41.17 76.67 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.55 -1.344 . . . . 0.0 109.232 177.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.785 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 13.1 t-80 -70.45 -29.95 66.66 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 117.481 -1.687 . . . . 0.0 110.463 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.661 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -62.5 -43.71 98.15 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.58 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 30.2 m170 -59.35 -46.52 88.41 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 10.6 mmm180 -55.07 -37.04 66.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.397 -0.814 . . . . 0.0 110.064 177.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.654 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.7 tm? -68.45 -45.16 73.24 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.89 -1.131 . . . . 0.0 109.024 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.679 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -50.07 -40.59 45.93 Favored 'General case' 0 N--CA 1.511 2.609 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 178.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.687 ' HD3' ' HD3' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -74.06 -41.26 62.01 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 120.9 -1.125 . . . . 0.0 109.598 177.075 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -52.79 -62.18 1.81 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.39 -59.88 2.7 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 118.729 -1.188 . . . . 0.0 111.39 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.611 HG22 ' HA ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -49.45 -32.52 12.08 Favored 'General case' 0 N--CA 1.518 2.956 0 O-C-N 120.422 -1.424 . . . . 0.0 108.131 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.613 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.07 -37.63 3.64 Favored Glycine 0 N--CA 1.492 2.428 0 CA-C-O 117.592 -1.671 . . . . 0.0 115.485 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 31.8 mmm -157.47 49.46 0.43 Allowed 'General case' 0 N--CA 1.521 3.083 0 CA-C-N 123.768 3.784 . . . . 0.0 116.496 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.966 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.59 82.57 0.55 Allowed Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 119.635 -1.915 . . . . 0.0 112.454 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.687 ' HD3' ' HD3' ' A' ' 121' ' ' LYS . 55.3 Cg_endo -73.89 -107.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 118.337 -0.642 . . . . 0.0 112.809 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.993 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.6 ttmt -60.25 -20.98 61.25 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.902 -1.124 . . . . 0.0 110.876 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.596 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.88 -33.8 74.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.782 -1.198 . . . . 0.0 108.237 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.966 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.35 -42.35 96.27 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 177.012 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.815 ' HG3' HD23 ' A' ' 94' ' ' LEU . 17.9 tt0 -54.05 -36.83 63.52 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.27 -54.22 22.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.347 -0.846 . . . . 0.0 109.506 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -52.77 -40.79 63.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.204 -0.935 . . . . 0.0 109.294 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.597 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.258 0.1 OUTLIER -55.5 -51.37 67.23 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 122.653 1.216 . . . . 0.0 108.237 177.428 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 1.8 ttm180 -65.92 -10.45 38.9 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.857 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.45 -41.23 10.41 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.153 -0.967 . . . . 0.0 110.055 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 ttm-85 -100.61 -50.14 3.98 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.24 -0.912 . . . . 0.0 111.484 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.463 ' O ' ' O ' ' A' ' 135' ' ' TRP . 3.4 ttt180 . . . . . 0 N--CA 1.497 1.896 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.759 -178.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.56 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -11.037 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.56 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 3 C3'-C2'-C1' 113.638 7.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.485 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 115.049 8.821 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.992 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.542 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.64 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.571 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.081 2 C3'-C2'-C1' 114.147 8.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.613 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.412 -10.621 1 C3'-C2'-C1' 114.2 8.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.613 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.289 2 C3'-C2'-C1' 114.996 8.783 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.487 ' C6 ' ' C6 ' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.769 8.621 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.589 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.589 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.903 2 C3'-C2'-C1' 114.715 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.785 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.447 8.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.643 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.801 1 C3'-C2'-C1' 114.588 8.492 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.588 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.582 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.496 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.086 2 C3'-C2'-C1' 115.712 9.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.496 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.569 2 C3'-C2'-C1' 114.914 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.5 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.82 2 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.5 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.407 -11.144 2 C3'-C2'-C1' 114.194 8.21 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.546 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.652 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.993 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.29 1 C3'-C2'-C1' 114.902 8.716 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.464 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.979 1 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.488 ' N4 ' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -9.992 1 C3'-C2'-C1' 114.431 8.379 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.489 ' N2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.463 2 C3'-C2'-C1' 115.141 8.886 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.449 ' H6 ' " H2'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.42 -9.786 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.471 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.374 1 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.648 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.969 2 C3'-C2'-C1' 114.742 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 115.086 8.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.751 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.404 -11.359 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.811 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.776 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 115.474 9.124 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.454 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.356 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.41 -10.809 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.459 2 C3'-C2'-C1' 114.292 8.28 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.194 0.521 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 53.39 92.9 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.412 -0.805 . . . . 0.0 110.547 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.93 145.43 33.03 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.402 -0.811 . . . . 0.0 110.306 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.566 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -65.78 -154.56 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.253 -0.905 . . . . 0.0 109.083 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 5' ' ' THR . 1.2 t -67.94 34.09 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.262 -0.899 . . . . 0.0 110.616 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.566 ' H ' ' C ' ' A' ' 4' ' ' ALA . 0.9 OUTLIER 79.84 53.06 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.59 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -171.61 35.58 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.326 -0.859 . . . . 0.0 111.672 -179.559 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.8 m -83.57 63.76 7.56 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 28.3 p-10 -54.09 -27.02 30.16 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.08 -46.86 88.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -86.84 -31.53 20.76 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 116.9 -1.92 . . . . 0.0 109.848 178.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 16' ' ' VAL . 13.1 mmt85 -51.93 -40.46 60.81 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.053 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 21.4 t-105 -65.39 -40.74 93.84 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.654 177.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 118.393 -1.323 . . . . 0.0 107.723 178.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 t -76.93 -29.02 55.46 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.817 0.817 . . . . 0.0 109.105 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 12' ' ' ARG . 93.5 t -78.12 -29.51 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-O 122.25 1.024 . . . . 0.0 111.284 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.053 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.4 mt -90.3 -31.5 16.92 Favored 'General case' 0 C--N 1.268 -2.976 0 CA-C-O 122.363 1.078 . . . . 0.0 109.059 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.728 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -71.94 -33.12 67.97 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.198 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.728 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 3.4 ptt180 88.74 31.27 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.82 109.46 2.26 Favored Pre-proline 0 C--N 1.301 -1.538 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.54 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 51.2 Cg_endo -75.05 6.21 3.54 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 O-C-N 123.768 1.404 . . . . 0.0 108.81 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.304 1.3 t30 -103.88 -11.45 17.49 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.944 0.878 . . . . 0.0 109.299 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.0 -5.72 15.36 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.846 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.256 29.8 t0 -77.18 127.76 33.19 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.749 -1.945 . . . . 0.0 105.749 179.043 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.771 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.88 -24.95 30.13 Favored Glycine 0 N--CA 1.505 3.265 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -87.12 -44.74 11.3 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.792 -0.828 . . . . 0.0 109.158 178.465 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 12.6 p90 -148.22 170.42 17.9 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 122.262 1.029 . . . . 0.0 110.719 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.757 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.6 176.15 8.01 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.155 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.787 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.3 OUTLIER -137.77 122.74 19.0 Favored 'General case' 0 C--N 1.281 -2.384 0 C-N-CA 118.396 -1.321 . . . . 0.0 109.014 176.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -103.16 115.76 31.19 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.1 -0.955 . . . . 0.0 113.365 -175.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.037 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.26 102.83 13.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.264 22.8 mtm180 -64.73 -20.16 66.18 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.841 0.829 . . . . 0.0 111.186 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.037 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -62.7 -28.8 70.19 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.953 0.883 . . . . 0.0 108.942 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' HB ' ' A' ' 31' ' ' VAL . 12.0 t -121.5 -6.56 9.24 Favored 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.214 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.47 30.38 69.04 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.935 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.3 mt -117.68 163.77 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.204 -1.174 . . . . 0.0 109.396 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.747 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.1 p90 -147.09 118.92 8.09 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.593 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.677 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.271 4.3 mtp-105 -84.47 168.85 18.9 Favored Pre-proline 0 C--N 1.284 -2.241 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.487 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.699 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.24 -14.81 47.07 Favored 'Trans proline' 0 C--N 1.29 -2.52 0 O-C-N 123.035 1.019 . . . . 0.0 111.055 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 60.4 p -115.24 30.45 7.35 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.559 -1.338 . . . . 0.0 112.991 -178.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.5 t -54.73 131.16 43.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.558 -1.339 . . . . 0.0 110.068 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.5 6.66 42.43 Favored 'General case' 0 C--N 1.289 -2.049 0 C-N-CA 120.419 -0.513 . . . . 0.0 112.275 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.557 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -84.0 -50.72 7.74 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 120.608 -1.308 . . . . 0.0 112.374 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.632 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 177.45 172.18 0.56 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.689 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.2 m-70 -140.63 159.66 41.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.288 -1.508 . . . . 0.0 114.092 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.625 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.45 158.19 27.74 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.55 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -54.78 158.22 2.75 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.027 -1.046 . . . . 0.0 111.444 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.628 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.282 0.0 OUTLIER -60.58 -30.25 69.69 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.943 1.354 . . . . 0.0 109.037 179.27 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -39.02 -61.51 0.74 Allowed 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.27 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.801 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.0 m-20 -91.58 17.3 8.94 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.46 132.29 61.6 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 CA-C-O 121.575 0.702 . . . . 0.0 111.65 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.787 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.7 p -127.21 175.32 8.25 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.4 m-85 -125.34 150.24 47.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.017 -1.052 . . . . 0.0 111.463 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.757 ' HB2' HG22 ' A' ' 28' ' ' VAL . 24.1 m-85 -129.45 155.16 46.16 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.079 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -67.97 -39.86 83.25 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -139.99 164.77 29.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.356 1.074 . . . . 0.0 110.635 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.26 -24.74 68.0 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.134 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.611 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.43 -36.67 71.36 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.64 -1.288 . . . . 0.0 108.82 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 60' ' ' GLU . 3.6 tp10 -60.92 -48.34 82.25 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -60.03 -44.96 94.27 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.703 HD21 ' HG3' ' A' ' 68' ' ' PRO . 71.0 mt -60.36 -28.08 67.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.02 -17.39 52.94 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.627 -0.67 . . . . 0.0 110.196 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.42 0.21 26.64 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.163 -0.96 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.13 38.78 9.78 Favored Glycine 0 C--N 1.284 -2.36 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.431 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -113.74 159.75 19.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.252 -1.146 . . . . 0.0 111.744 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.02 114.82 65.84 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.712 ' HB2' ' HB2' ' A' ' 73' ' ' GLN . 33.3 Cg_endo -60.43 136.87 70.57 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 123.488 1.257 . . . . 0.0 110.848 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.758 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -57.55 123.58 16.04 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.507 0.67 . . . . 0.0 110.382 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.3 tttt -56.36 0.52 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.849 -0.532 . . . . 0.0 112.261 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.499 ' HG2' ' HD2' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -114.48 -35.38 4.94 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 122.127 0.965 . . . . 0.0 109.161 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.543 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 22.1 m -89.99 -20.68 23.0 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.237 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.712 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -79.96 -45.01 1.5 Allowed Pre-proline 0 C--N 1.3 -1.55 0 O-C-N 121.65 -0.656 . . . . 0.0 111.635 -178.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 46.2 Cg_endo -74.3 -39.14 1.68 Allowed 'Trans proline' 0 C--N 1.315 -1.191 0 O-C-N 122.906 0.95 . . . . 0.0 111.386 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.677 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.22 178.14 5.99 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.929 -1.107 . . . . 0.0 109.679 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 11.2 mmtt -114.08 139.83 48.98 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.266 -0.896 . . . . 0.0 111.298 -179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.771 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -82.41 -112.56 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.004 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -58.07 -30.56 8.04 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 119.683 -1.885 . . . . 0.0 108.11 175.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.004 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 56.4 Cg_endo -60.41 -16.65 42.96 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 N-CA-C 108.362 -1.438 . . . . 0.0 108.362 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -51.03 -61.2 2.37 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.154 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -50.48 -34.34 24.61 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.475 -0.766 . . . . 0.0 111.329 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 6.2 t60 -69.01 -41.17 78.11 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.045 -1.034 . . . . 0.0 109.279 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -67.94 -25.72 65.6 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.943 -1.098 . . . . 0.0 109.004 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.058 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.61 -29.89 52.11 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.6 OUTLIER -61.67 -37.63 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 176.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -56.34 -52.88 62.92 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.703 0.763 . . . . 0.0 109.547 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.919 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 30.2 mm -53.71 -43.86 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 O-C-N 121.039 -1.038 . . . . 0.0 110.983 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.893 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.2 m -52.55 -41.58 63.65 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.054 -1.654 . . . . 0.0 107.828 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -57.11 -39.06 74.35 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.814 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.9 -33.78 62.37 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.893 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.75 -54.98 35.07 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.643 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 96' ' ' GLN . 2.8 tpp180 -48.71 -58.1 5.27 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.329 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 93' ' ' LEU . 2.5 mm? -55.4 -36.59 66.58 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 112.211 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.814 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.96 -10.81 59.31 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.562 -0.711 . . . . 0.0 110.237 -177.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 136' ' ' ARG . 28.4 tp10 -135.56 -3.64 2.35 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.279 -0.888 . . . . 0.0 109.691 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -83.47 -43.37 15.88 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.204 -0.935 . . . . 0.0 109.106 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -87.24 -155.58 0.29 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.521 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.6 m -105.32 -71.37 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.117 -0.99 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.8 Cg_endo -65.83 140.65 62.04 Favored 'Trans proline' 0 C--N 1.315 -1.21 0 N-CA-C 109.274 -1.087 . . . . 0.0 109.274 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.93 137.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 120.762 -1.211 . . . . 0.0 108.368 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.88 110.87 20.33 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.936 0.874 . . . . 0.0 111.746 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.832 HD23 ' CB ' ' A' ' 113' ' ' PRO . 1.1 mp -126.69 -32.44 2.61 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -40.72 -45.53 2.43 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.483 -0.76 . . . . 0.0 111.884 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.89 -44.7 92.23 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.024 . . . . 0.0 108.795 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.841 ' C ' HD13 ' A' ' 105' ' ' LEU . 2.2 tm? -64.35 -53.59 46.25 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.97 -46.64 68.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.552 -0.718 . . . . 0.0 111.507 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.85 -33.17 75.01 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.153 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -32.9 63.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.159 -0.963 . . . . 0.0 111.354 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 8.2 t -99.53 -13.35 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 120.964 -1.085 . . . . 0.0 111.102 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.69 32.58 0.22 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.63 -0.669 . . . . 0.0 110.259 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.735 ' HB2' ' HB3' ' A' ' 115' ' ' HIS . 1.1 ptt? -139.88 158.94 43.27 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.424 -0.798 . . . . 0.0 111.351 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.412 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.25 170.85 12.21 Favored Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.621 -0.675 . . . . 0.0 111.306 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.832 ' CB ' HD23 ' A' ' 102' ' ' LEU . 36.3 Cg_endo -59.63 -38.4 82.01 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 O-C-N 123.65 1.342 . . . . 0.0 111.227 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 13.6 m-30 -68.99 -34.71 75.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 117.744 -1.583 . . . . 0.0 108.877 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.798 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.6 t-80 -70.56 -27.0 63.8 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 116.736 -1.986 . . . . 0.0 110.573 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -61.11 -46.56 90.12 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.503 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.585 ' CE1' ' HB2' ' A' ' 132' ' ' GLN . 93.2 m-70 -61.69 -37.06 82.73 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.428 ' NH2' ' N7 ' ' C' ' 225' ' ' ' DG' . 14.8 tpp180 -63.19 -33.31 75.2 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.044 -1.035 . . . . 0.0 109.175 177.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 119' ' ' LEU . 0.4 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 177.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.919 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.254 0.3 OUTLIER -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.51 2.573 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.125 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -72.47 -42.73 64.6 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.217 -0.927 . . . . 0.0 110.825 177.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.28 -55.78 30.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.316 -0.865 . . . . 0.0 109.101 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 1.058 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -68.91 -60.48 2.34 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.72 -0.792 . . . . 0.0 110.816 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.777 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -52.61 -33.36 46.11 Favored 'General case' 0 N--CA 1.514 2.766 0 O-C-N 120.47 -1.394 . . . . 0.0 108.735 178.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.549 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.17 -30.16 8.55 Favored Glycine 0 N--CA 1.497 2.744 0 CA-C-O 117.901 -1.5 . . . . 0.0 115.452 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.595 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 1.2 mtt -162.04 49.17 0.19 Allowed 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 123.158 3.479 . . . . 0.0 115.74 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.979 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.69 80.24 0.56 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 119.706 -1.871 . . . . 0.0 112.78 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.719 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 48.1 Cg_endo -69.79 -106.0 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.232 0 CA-C-N 118.753 0.59 . . . . 0.0 113.045 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.846 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 17.1 tptt -60.18 -21.08 61.26 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.613 -1.304 . . . . 0.0 111.139 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.986 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.07 -37.76 78.66 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.742 -1.224 . . . . 0.0 108.899 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.979 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.51 -37.24 86.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 178.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.652 ' HG3' HD22 ' A' ' 94' ' ' LEU . 15.0 tt0 -57.88 -40.64 80.73 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -63.76 -51.27 65.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.486 -0.759 . . . . 0.0 109.07 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.79 68.83 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.258 -0.901 . . . . 0.0 109.289 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.583 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.17 -51.99 60.24 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 122.424 1.107 . . . . 0.0 108.668 177.835 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.507 ' HA ' ' CG ' ' A' ' 95' ' ' GLU . 2.8 ttt180 -67.64 -10.89 56.21 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.134 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.08 -39.91 10.81 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.142 -0.974 . . . . 0.0 110.463 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.44 -48.62 4.5 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.293 -0.879 . . . . 0.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.459 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.798 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.555 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.383 1 C3'-C2'-C1' 114.781 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.555 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.751 3 C3'-C2'-C1' 113.632 7.808 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.475 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.79 2 C3'-C2'-C1' 114.935 8.739 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.545 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.108 2 C3'-C2'-C1' 115.097 8.855 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.545 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.992 2 C3'-C2'-C1' 114.798 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.538 " O5'" H2'' ' B' ' 194' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.42 -9.764 2 C3'-C2'-C1' 114.182 8.201 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.605 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.807 2 C3'-C2'-C1' 114.153 8.18 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.605 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.034 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.424 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.901 2 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.633 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.727 1 C3'-C2'-C1' 115.307 9.005 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.633 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.708 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.798 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.52 1 C3'-C2'-C1' 114.763 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.647 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.893 1 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.584 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.572 2 C3'-C2'-C1' 114.767 8.619 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.493 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.6 9.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.06 8.828 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.549 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.893 2 C3'-C2'-C1' 114.772 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.549 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.315 2 C3'-C2'-C1' 114.744 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.442 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.183 2 C3'-C2'-C1' 114.308 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.586 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.096 2 C3'-C2'-C1' 114.608 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.647 " H3'" ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.986 ' OP1' ' HB2' ' A' ' 130' ' ' ALA . . . . . . . . 2 C3'--C2' 1.419 -9.876 1 C3'-C2'-C1' 114.892 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.949 1 C3'-C2'-C1' 114.974 8.767 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.628 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.874 2 C3'-C2'-C1' 114.506 8.433 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.628 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.262 1 C3'-C2'-C1' 115.084 8.846 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.474 ' C4 ' ' C8 ' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.951 2 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.454 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.389 1 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.64 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.64 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.408 -11.021 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.609 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.218 2 C3'-C2'-C1' 115.202 8.93 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.758 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.405 -11.273 1 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.935 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.793 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 115.546 9.176 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.455 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.413 2 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.405 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.84 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.404 2 C3'-C2'-C1' 114.28 8.272 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.055 0.455 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB3' HG21 ' A' ' 8' ' ' THR . 11.7 mtmm 52.11 94.28 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.399 -0.813 . . . . 0.0 110.601 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -167.08 70.43 0.1 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.128 -0.982 . . . . 0.0 110.742 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.484 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -78.88 -154.7 0.08 Allowed 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.195 -0.941 . . . . 0.0 108.682 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.576 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 4.3 m -70.62 38.37 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 O-C-N 120.998 -1.064 . . . . 0.0 110.18 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.582 ' O ' HD22 ' A' ' 7' ' ' LEU . 37.7 m 79.41 61.98 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.736 -0.602 . . . . 0.0 109.547 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.582 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -157.9 28.95 0.26 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 121.317 -0.864 . . . . 0.0 111.962 -179.125 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.596 HG21 ' HB3' ' A' ' 2' ' ' LYS . 21.0 m -79.97 64.36 4.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 107.993 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.6 p-10 -39.61 -32.48 0.13 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.198 0.523 . . . . 0.0 110.428 -179.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -53.06 62.53 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.554 -0.716 . . . . 0.0 109.826 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.496 ' H ' HG22 ' A' ' 8' ' ' THR . 0.1 OUTLIER -84.23 -27.59 27.86 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.728 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 16' ' ' VAL . 1.4 mmp_? -51.77 -42.9 62.74 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 177.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.069 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 36.4 t-105 -65.84 -40.74 92.03 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 118.754 -1.178 . . . . 0.0 108.511 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 8.6 tt0 -60.98 -29.66 69.81 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 117.805 -1.558 . . . . 0.0 107.76 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 75.7 m -77.85 -32.51 52.11 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.963 ' HA ' ' HA ' ' A' ' 40' ' ' PRO . 85.5 t -70.93 -27.28 29.64 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 CA-C-O 122.335 1.064 . . . . 0.0 110.926 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.069 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.266 1.3 mt -95.07 -31.29 13.65 Favored 'General case' 0 C--N 1.264 -3.138 0 CA-C-O 122.286 1.041 . . . . 0.0 108.466 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -77.55 -11.69 59.88 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.562 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.521 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 2.7 mtt85 60.76 43.11 12.57 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.151 -0.968 . . . . 0.0 109.253 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 22' ' ' ASN . 46.7 t0 -70.08 110.21 6.28 Favored Pre-proline 0 C--N 1.302 -1.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.081 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 46.7 Cg_endo -71.71 6.03 2.2 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.693 1.365 . . . . 0.0 109.906 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.482 ' C ' HD21 ' A' ' 78' ' ' ASN 0.316 1.2 t30 -107.07 -11.67 15.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.939 0.875 . . . . 0.0 109.024 -178.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.662 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.39 -5.87 15.1 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-O 122.276 1.036 . . . . 0.0 108.241 176.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.842 ' O ' ' N ' ' A' ' 78' ' ' ASN . 21.7 t0 -73.99 123.23 23.94 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.564 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.75 -33.41 6.43 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 106.85 -2.5 . . . . 0.0 106.85 -176.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 4.7 tm-20 -71.22 -48.19 52.8 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.653 -0.91 . . . . 0.0 108.741 178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 15.7 p90 -142.21 170.57 15.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.397 1.094 . . . . 0.0 110.25 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -126.84 175.79 8.2 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.64 119.68 12.76 Favored 'General case' 0 C--N 1.282 -2.328 0 C-N-CA 118.367 -1.333 . . . . 0.0 108.666 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.5 113.1 24.98 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.279 -175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.964 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.54 112.51 24.0 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 12.4 mtm-85 -70.13 -20.09 63.19 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.94 0.876 . . . . 0.0 111.219 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.964 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -67.45 -32.75 73.82 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-O 121.656 0.741 . . . . 0.0 109.134 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.667 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -115.38 -4.96 12.3 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.063 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 34.78 89.68 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.721 HD13 ' OP2' ' C' ' 234' ' ' ' DT' . 86.7 mt -125.17 166.98 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.149 -1.207 . . . . 0.0 108.316 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.773 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.5 p90 -145.72 114.84 7.02 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.429 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.681 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.49 176.73 2.31 Favored Pre-proline 0 C--N 1.284 -2.248 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.963 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 37.7 Cg_endo -64.21 -21.9 67.23 Favored 'Trans proline' 0 C--N 1.288 -2.629 0 O-C-N 123.573 1.302 . . . . 0.0 112.64 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 4.9 p -115.07 30.95 7.01 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.472 -1.393 . . . . 0.0 112.951 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.5 t -43.25 138.78 2.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.742 -1.224 . . . . 0.0 110.422 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.493 ' CB ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -100.68 3.72 42.62 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.26 -179.123 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.12 -50.87 5.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.504 -1.373 . . . . 0.0 111.42 -179.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.825 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.2 OUTLIER 169.24 -169.81 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 179.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.987 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 3.8 m-70 -140.81 158.46 43.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 119.975 -1.703 . . . . 0.0 114.672 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.938 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -113.95 166.1 11.94 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.892 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -56.04 161.9 2.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.211 -0.931 . . . . 0.0 112.555 -178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.284 5.8 ttm180 -76.91 -30.43 56.15 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 123.078 1.418 . . . . 0.0 109.51 179.488 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 1.1 tm-20 -41.82 -61.25 1.15 Allowed 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.809 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.68 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.0 m-80 -87.08 16.92 4.56 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 121.644 0.735 . . . . 0.0 109.417 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.782 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -106.9 125.75 62.91 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 O-C-N 121.25 -0.906 . . . . 0.0 112.597 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.786 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -122.59 175.39 6.51 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 89.0 m-85 -124.71 150.15 46.47 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.016 -1.052 . . . . 0.0 111.398 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.726 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.9 m-85 -130.64 154.8 47.51 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.898 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.492 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.08 -39.96 71.85 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -137.47 162.04 34.74 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.352 1.072 . . . . 0.0 110.578 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.717 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -61.52 -23.25 65.8 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.164 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.606 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.53 -36.21 70.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.589 -1.319 . . . . 0.0 108.871 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 28.9 tp10 -62.28 -50.41 71.82 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.741 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.98 -42.4 89.91 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 122.172 0.987 . . . . 0.0 108.425 176.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.812 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.0 mt -62.86 -28.56 70.11 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.5 -16.86 55.3 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 121.572 -0.705 . . . . 0.0 110.219 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.25 0.2 29.6 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.171 -0.955 . . . . 0.0 110.661 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.67 44.91 6.26 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.405 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 18.5 m-85 -120.06 162.82 18.62 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.335 -1.097 . . . . 0.0 112.045 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 114.9 65.88 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.812 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.9 Cg_endo -63.6 138.31 63.95 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 O-C-N 123.402 1.211 . . . . 0.0 110.981 -178.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.449 ' C ' ' H ' ' A' ' 71' ' ' ARG . 7.3 t -73.07 109.52 6.66 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.619 ' CB ' ' OP1' ' C' ' 233' ' ' ' DA' . 10.5 tttp -55.53 -2.26 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.734 -1.229 . . . . 0.0 111.41 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.88 ' HB2' " C5'" ' C' ' 233' ' ' ' DA' . 9.2 tpt180 -92.29 -34.47 14.21 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.562 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 56.9 m -101.78 -0.96 33.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.5 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.506 ' CB ' ' HD3' ' A' ' 74' ' ' PRO . 1.5 tt0 -96.75 -52.84 0.22 Allowed Pre-proline 0 C--N 1.298 -1.637 0 O-C-N 120.832 -1.168 . . . . 0.0 110.911 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 54.2 Cg_endo -92.73 -7.41 2.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.043 1.162 . . . . 0.0 111.855 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.634 ' HB3' ' O ' ' A' ' 71' ' ' ARG . 26.9 p-10 -74.87 178.62 5.41 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.866 -1.146 . . . . 0.0 112.4 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' CG ' ' A' ' 80' ' ' ARG . 55.3 mmtt -88.67 140.23 29.67 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.779 0.8 . . . . 0.0 110.936 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.681 ' HB2' ' NH2' ' A' ' 39' ' ' ARG . . . -156.05 -122.04 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.973 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m120 -64.8 -30.96 4.92 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 119.475 -2.016 . . . . 0.0 107.737 175.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.973 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -65.03 -22.25 62.52 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 N-CA-C 107.617 -1.724 . . . . 0.0 107.617 174.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -53.52 -63.34 1.18 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.559 -0.713 . . . . 0.0 109.244 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.13 -34.7 32.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.558 -0.713 . . . . 0.0 111.559 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -69.49 -42.17 75.16 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.158 -0.964 . . . . 0.0 109.73 -179.71 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.408 ' CZ ' ' HE3' ' A' ' 76' ' ' LYS . 2.3 ttt-85 -67.61 -26.49 66.28 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.144 -0.973 . . . . 0.0 108.896 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.781 ' CD2' ' HA ' ' A' ' 124' ' ' THR . 42.9 tp -77.66 -31.57 52.67 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.374 -1.33 . . . . 0.0 108.331 178.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 2.8 m-20 -59.92 -37.82 80.58 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -58.49 -52.59 65.0 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.676 0.751 . . . . 0.0 109.374 177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.76 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 21.0 mm -52.43 -45.11 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.123 -0.985 . . . . 0.0 111.088 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 4.5 m -51.89 -44.68 63.85 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.478 -1.389 . . . . 0.0 107.739 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -55.09 -38.75 68.51 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.817 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.88 -40.08 69.36 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 177.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 17.4 t -62.56 -48.11 80.93 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.522 -1.271 . . . . 0.0 108.893 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' A' ' 96' ' ' GLN . 8.9 tpp180 -48.37 -63.82 0.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.653 -0.654 . . . . 0.0 110.06 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 90' ' ' ALA . 3.5 pp -52.21 -35.29 48.89 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.376 -0.827 . . . . 0.0 111.029 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.778 HD12 ' O ' ' A' ' 90' ' ' ALA 0.258 0.1 OUTLIER -68.11 -10.66 55.76 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.263 -0.898 . . . . 0.0 109.904 -178.738 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 8.3 tp10 -131.2 -7.84 3.82 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.734 -0.604 . . . . 0.0 109.585 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' A' ' 92' ' ' ARG . 27.4 tt0 -82.46 -45.41 14.79 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.36 -0.838 . . . . 0.0 110.097 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.495 ' CD ' ' C ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -79.32 -155.82 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.197 -1.401 . . . . 0.0 109.888 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.649 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.41 -67.24 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.104 -0.998 . . . . 0.0 108.372 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.649 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 42.8 Cg_endo -67.3 141.05 55.21 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 121.936 1.757 . . . . 0.0 109.285 175.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.14 154.3 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 O-C-N 120.231 -1.543 . . . . 0.0 110.175 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.71 121.12 22.61 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.026 -1.046 . . . . 0.0 112.628 -177.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.13 -41.52 1.12 Allowed 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -40.62 -45.43 2.34 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.866 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.75 98.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.022 -1.049 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.868 HD22 HD13 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -69.47 -39.25 77.81 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.719 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -64.98 -43.42 92.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 110.253 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.69 -32.32 72.06 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.391 -0.818 . . . . 0.0 110.741 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.86 -41.32 71.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.786 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.797 HG11 ' CE ' ' A' ' 111' ' ' MET . 4.3 t -88.51 -11.85 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.808 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 30.22 0.29 Allowed 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.483 -0.761 . . . . 0.0 110.267 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.797 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.13 165.65 26.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.413 -0.804 . . . . 0.0 110.817 179.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.13 170.72 12.65 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.611 -0.681 . . . . 0.0 111.023 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.83 -33.02 66.18 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.814 1.428 . . . . 0.0 109.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.618 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.67 -38.54 77.1 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.22 177.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.686 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 4.7 t-80 -70.65 -25.99 63.26 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 116.232 -2.187 . . . . 0.0 110.444 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.871 HD23 HD23 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -62.93 -43.33 99.1 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' PRO . 19.7 m170 -58.66 -48.01 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.544 HH12 ' N4 ' ' C' ' 226' ' ' ' DC' . 0.0 OUTLIER -54.87 -36.65 65.34 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.617 -0.677 . . . . 0.0 110.253 178.151 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -69.62 -49.11 56.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.943 -1.098 . . . . 0.0 108.977 177.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.668 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.4 OUTLIER -50.21 -37.43 35.29 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 121.35 -0.844 . . . . 0.0 109.036 177.544 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.668 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -77.14 -36.65 55.18 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.991 -1.068 . . . . 0.0 109.98 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.97 -54.33 46.26 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 84' ' ' LEU . 10.8 m -68.71 -60.19 2.58 Favored 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.233 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.781 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . 1.0 OUTLIER -51.75 -32.38 30.48 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.757 -1.214 . . . . 0.0 108.473 176.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.536 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.04 -40.08 2.67 Favored Glycine 0 N--CA 1.491 2.361 0 CA-C-O 118.027 -1.43 . . . . 0.0 114.253 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.536 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 5.3 mtt -160.01 49.1 0.28 Allowed 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 123.012 3.406 . . . . 0.0 115.46 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.932 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.77 92.81 0.46 Allowed Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 120.257 -1.527 . . . . 0.0 110.457 176.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.668 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.4 Cg_endo -66.27 -108.06 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 122.649 0.816 . . . . 0.0 113.738 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.855 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 15.1 tppt? -60.06 -23.13 63.52 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.875 -1.14 . . . . 0.0 110.83 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.808 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.91 -39.62 79.57 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.274 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.932 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.85 -37.57 88.08 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.81 -1.181 . . . . 0.0 108.708 177.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 94' ' ' LEU . 3.8 tt0 -62.26 -45.91 91.17 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.245 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -45.95 83.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.474 -0.766 . . . . 0.0 110.37 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.26 -59.0 6.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.148 -0.97 . . . . 0.0 110.224 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.531 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -46.77 -49.1 20.28 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.852 0.834 . . . . 0.0 109.632 178.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.439 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 1.2 ttp180 -60.53 -33.89 73.31 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.215 0.531 . . . . 0.0 110.509 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -72.6 -28.14 62.6 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.324 -0.86 . . . . 0.0 110.468 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -86.18 -19.69 29.69 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.488 ' NE ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 ttm-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.061 -1.024 . . . . 0.0 109.681 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.502 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.347 1 C3'-C2'-C1' 114.68 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.553 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.712 3 C3'-C2'-C1' 113.74 7.885 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.553 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 115.127 8.877 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.448 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.16 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.448 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.621 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.197 2 C3'-C2'-C1' 114.205 8.218 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.621 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.839 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.587 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.96 2 C3'-C2'-C1' 114.933 8.738 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.493 " H4'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.016 2 C3'-C2'-C1' 114.605 8.504 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.592 1 C3'-C2'-C1' 115.039 8.814 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.505 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.153 1 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.686 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.585 1 C3'-C2'-C1' 114.492 8.423 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.672 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.412 -10.616 1 C3'-C2'-C1' 114.571 8.479 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.571 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.798 2 C3'-C2'-C1' 114.561 8.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.508 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.222 2 C3'-C2'-C1' 115.789 9.35 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.508 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.832 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.545 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.787 2 C3'-C2'-C1' 114.714 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.545 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.403 2 C3'-C2'-C1' 114.758 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.403 -11.456 2 C3'-C2'-C1' 114.273 8.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.566 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.54 8.457 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.618 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.419 -9.908 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.855 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.426 1 C3'-C2'-C1' 114.925 8.732 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.515 ' C6 ' ' NH1' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.763 1 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.544 ' N4 ' HH12 ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.069 2 C3'-C2'-C1' 114.473 8.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.53 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.874 1 C3'-C2'-C1' 115.285 8.989 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.45 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.762 2 C3'-C2'-C1' 114.745 8.603 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.487 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.447 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.559 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.023 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.639 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.951 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.674 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.844 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.88 " C5'" ' HB2' ' A' ' 71' ' ' ARG . . . . . . . . 2 C3'--C2' 1.401 -11.674 2 C3'-C2'-C1' 114.072 8.123 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.825 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.412 -10.647 2 C3'-C2'-C1' 114.6 8.5 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.987 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.692 2 C3'-C2'-C1' 115.661 9.258 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.441 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.719 8.585 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.42 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.503 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.389 2 C3'-C2'-C1' 114.278 8.27 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.093 0.473 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 1.0 OUTLIER 65.15 -137.43 0.22 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.41 -0.806 . . . . 0.0 110.598 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.58 ' HB3' HG21 ' A' ' 8' ' ' THR . 70.6 mttt 63.87 149.0 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.05 -1.031 . . . . 0.0 109.829 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -98.66 165.87 11.6 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.134 -0.979 . . . . 0.0 111.614 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.638 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 3.0 p -66.12 77.69 0.09 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.506 0.67 . . . . 0.0 109.396 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.638 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.8 t 89.37 -178.27 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.808 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.8 OUTLIER 54.53 24.59 5.46 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.919 -1.113 . . . . 0.0 109.463 -179.363 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.5 m -99.67 64.33 1.28 Allowed 'General case' 0 C--N 1.296 -1.737 0 C-N-CA 119.739 -0.784 . . . . 0.0 109.403 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.578 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 25.0 p-10 -43.53 -30.49 0.59 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.476 -0.765 . . . . 0.0 109.343 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 2.7 m-20 -58.22 -46.61 85.57 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.673 ' H ' HG22 ' A' ' 8' ' ' THR . 2.2 tt0 -79.59 -33.38 41.68 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.168 -1.413 . . . . 0.0 109.13 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.4 mtt85 -52.16 -40.0 60.81 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 104.647 -2.353 . . . . 0.0 104.647 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.982 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 19.1 t-105 -62.99 -40.5 97.93 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 176.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.53 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.92 -34.1 74.17 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.593 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 1.4 t -70.26 -29.26 66.0 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 122.032 0.92 . . . . 0.0 108.52 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 46.1 t -75.34 -35.27 32.76 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 122.413 1.101 . . . . 0.0 111.522 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.982 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.264 1.8 mt -90.19 -30.67 17.44 Favored 'General case' 0 C--N 1.261 -3.255 0 CA-C-O 122.287 1.042 . . . . 0.0 109.39 -179.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.802 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -76.66 -24.29 53.27 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.191 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.802 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 83.07 36.21 0.05 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -178.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -69.32 110.02 5.51 Favored Pre-proline 0 C--N 1.302 -1.475 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.128 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 50.5 Cg_endo -74.23 6.36 3.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.786 1.414 . . . . 0.0 109.823 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.301 1.2 t30 -101.78 -11.55 19.0 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.958 0.885 . . . . 0.0 109.278 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.19 -5.86 15.21 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-O 122.144 0.973 . . . . 0.0 108.416 177.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.927 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.7 t0 -77.62 125.8 29.89 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.786 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.96 -28.34 16.49 Favored Glycine 0 N--CA 1.509 3.56 0 N-CA-C 106.464 -2.654 . . . . 0.0 106.464 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' ALA . 9.5 tm-20 -85.33 -41.56 15.39 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.855 -0.791 . . . . 0.0 109.262 178.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.814 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.0 p90 -150.64 170.32 19.47 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 122.334 1.064 . . . . 0.0 110.717 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.736 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.67 175.81 9.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.153 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.824 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -137.97 122.03 17.91 Favored 'General case' 0 C--N 1.28 -2.436 0 C-N-CA 118.252 -1.379 . . . . 0.0 109.192 177.02 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -100.05 114.04 27.07 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.079 -0.964 . . . . 0.0 113.394 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.999 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.62 104.19 14.14 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.274 27.6 mtm105 -65.08 -20.27 66.39 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.974 0.893 . . . . 0.0 111.075 -178.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.999 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -63.36 -30.04 71.24 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.912 0.863 . . . . 0.0 109.102 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.586 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 13.7 t -121.15 -7.09 9.41 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.182 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.05 28.58 70.16 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.868 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 64.4 mt -115.96 164.23 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.158 -1.201 . . . . 0.0 109.043 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.7 p90 -146.73 119.2 8.45 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.524 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.67 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.285 16.6 mtm180 -82.58 164.47 47.11 Favored Pre-proline 0 C--N 1.286 -2.192 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.697 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 37.5 Cg_endo -64.44 -11.81 30.18 Favored 'Trans proline' 0 C--N 1.29 -2.546 0 O-C-N 122.881 0.938 . . . . 0.0 110.798 -179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.747 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 85.8 p -115.38 30.61 7.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.508 -1.37 . . . . 0.0 112.837 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 45.4 t -55.06 138.65 43.61 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.469 -1.395 . . . . 0.0 109.699 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH1' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -101.17 1.05 38.71 Favored 'General case' 0 C--N 1.288 -2.085 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.044 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.554 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -85.28 -50.83 7.03 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.229 -1.544 . . . . 0.0 113.347 -176.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.618 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.5 OUTLIER 177.67 172.64 0.58 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.854 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.8 m-70 -140.2 157.12 46.1 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.461 -1.399 . . . . 0.0 114.232 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.617 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.08 148.58 43.42 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.661 177.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.18 161.3 0.17 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 111.647 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.585 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 14.7 ttp85 -59.88 -30.26 68.87 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.8 1.286 . . . . 0.0 109.001 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 51' ' ' ASN 0.275 0.6 OUTLIER -37.46 -62.39 0.53 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.164 -1.38 . . . . 0.0 112.164 -179.692 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.882 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.3 m-20 -94.16 17.37 12.71 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.633 HG22 ' CD1' ' A' ' 29' ' ' PHE . 2.1 t -117.2 133.68 63.17 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.423 0.63 . . . . 0.0 111.533 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.824 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 5.2 p -128.18 175.25 8.58 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 75.9 m-85 -122.12 150.22 42.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.22 1.01 . . . . 0.0 111.899 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.736 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.1 m-85 -131.76 154.94 48.55 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.576 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -68.15 -39.88 82.52 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.4 p30 -141.2 166.9 23.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 122.433 1.111 . . . . 0.0 110.52 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.22 -23.21 67.23 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.187 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.7 -36.51 70.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.675 -1.266 . . . . 0.0 108.991 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 14.8 tp10 -62.11 -48.84 78.39 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.91 -43.98 94.53 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.805 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.0 mt -61.01 -27.27 68.2 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.5 -18.05 52.8 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.641 -0.662 . . . . 0.0 109.966 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.2 0.13 26.28 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 110.33 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.94 35.95 17.01 Favored Glycine 0 C--N 1.285 -2.301 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 6.7 m-85 -108.83 161.05 15.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.209 -1.171 . . . . 0.0 111.468 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -99.76 114.39 65.61 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.2 Cg_endo -62.43 136.87 61.68 Favored 'Trans proline' 0 C--N 1.304 -1.799 0 O-C-N 123.622 1.327 . . . . 0.0 110.659 -178.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.942 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.6 t -56.32 120.99 8.52 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.545 0.688 . . . . 0.0 109.846 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 3.1 tmtm? -56.66 -0.1 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.765 -0.585 . . . . 0.0 111.912 -177.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.536 ' CD ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -114.18 -33.62 5.61 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 120.666 -1.271 . . . . 0.0 108.956 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 7.3 m -89.96 -23.48 21.53 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.343 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 5.4 tt0 -79.96 -44.68 1.49 Allowed Pre-proline 0 C--N 1.3 -1.554 0 O-C-N 121.684 -0.635 . . . . 0.0 112.332 -178.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.7 Cg_endo -72.84 -39.97 2.13 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 122.827 0.909 . . . . 0.0 111.073 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.67 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -74.98 178.15 5.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.024 -1.048 . . . . 0.0 109.99 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.733 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 33.3 mmtt -105.97 140.55 38.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 112.38 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.786 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.87 -109.02 0.07 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.013 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 6.1 m120 -62.31 -30.51 6.16 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 119.516 -1.99 . . . . 0.0 107.835 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.013 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.9 Cg_endo -61.7 -18.43 60.29 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 N-CA-C 107.597 -1.732 . . . . 0.0 107.597 176.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.733 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 3.2 ttm180 -58.34 -64.57 0.87 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -49.67 -34.58 18.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.439 -0.788 . . . . 0.0 111.6 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -69.03 -43.84 73.93 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 121.201 -0.937 . . . . 0.0 109.376 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -67.73 -24.09 65.33 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.923 -1.111 . . . . 0.0 108.933 178.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.012 HD21 ' HA ' ' A' ' 124' ' ' THR . 13.7 tp -77.6 -31.77 53.15 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.225 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.86 -37.6 85.13 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 176.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -58.94 -48.95 79.68 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.375 0.607 . . . . 0.0 110.037 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -59.08 -40.82 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 120.788 -1.195 . . . . 0.0 110.362 179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.848 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 5.7 m -52.85 -42.52 65.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.279 -1.513 . . . . 0.0 107.725 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -57.09 -39.57 75.3 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.868 ' O ' HD13 ' A' ' 94' ' ' LEU . . . -54.83 -35.11 63.61 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 177.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.848 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.37 -58.67 6.81 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 139' ' ' ARG . 5.5 tpp180 -47.03 -52.94 13.66 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.696 0.76 . . . . 0.0 110.097 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 96' ' ' GLN . 3.1 mm? -56.02 -36.09 67.57 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.619 -0.675 . . . . 0.0 111.478 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.14 HD11 HD13 ' A' ' 102' ' ' LEU . 4.1 mp -68.29 -10.94 58.35 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.66 ' HB3' ' O ' ' A' ' 139' ' ' ARG . 19.1 tp10 -132.19 4.55 4.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.227 -0.92 . . . . 0.0 108.946 175.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 92' ' ' ARG . 1.7 tm0? -89.21 -58.09 2.66 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.418 -0.802 . . . . 0.0 109.737 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.667 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.83 -155.94 0.33 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 118.245 -1.382 . . . . 0.0 110.398 179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.667 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.0 m -105.05 -60.25 0.05 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 108.784 178.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.621 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -66.35 140.74 59.41 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 N-CA-C 108.341 -1.446 . . . . 0.0 108.341 175.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 94' ' ' LEU . 21.9 t -78.03 153.07 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 O-C-N 120.069 -1.644 . . . . 0.0 110.721 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 99.87 4.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.172 0.986 . . . . 0.0 113.1 -178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.14 HD13 HD11 ' A' ' 94' ' ' LEU . 1.2 tp -130.55 -8.61 4.11 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -40.89 -45.39 2.51 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.88 -0.512 . . . . 0.0 111.697 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.47 -38.65 84.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.798 -1.189 . . . . 0.0 108.302 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.971 HD12 HD13 ' A' ' 116' ' ' LEU . 1.3 tm? -66.11 -57.76 6.97 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.01 -36.73 65.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -38.06 88.62 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 121.465 0.65 . . . . 0.0 109.541 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.31 -46.23 70.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.63 -0.669 . . . . 0.0 110.045 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.715 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 2.1 t -73.14 -21.81 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.193 -0.942 . . . . 0.0 109.061 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.65 28.32 0.33 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.835 -0.541 . . . . 0.0 111.792 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.539 ' HE2' ' HB3' ' A' ' 115' ' ' HIS . 2.5 ptm -140.58 -173.94 3.83 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.726 -1.234 . . . . 0.0 112.043 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.14 170.57 8.49 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.73 -0.606 . . . . 0.0 110.784 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.915 ' HA ' HD23 ' A' ' 116' ' ' LEU . 39.0 Cg_endo -64.93 -29.79 57.73 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.896 1.472 . . . . 0.0 110.422 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.567 ' CD1' ' HE2' ' A' ' 129' ' ' LYS . 10.4 m-30 -69.27 -50.12 49.88 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 118.562 -1.255 . . . . 0.0 110.311 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.714 ' CE1' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.2 -20.48 62.27 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 115.596 -2.442 . . . . 0.0 110.556 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.036 HD21 HD23 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -65.48 -37.1 85.82 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 176.256 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.638 ' ND1' ' HG3' ' A' ' 129' ' ' LYS . 29.2 m170 -63.35 -42.3 98.92 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.716 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -59.28 -34.01 71.76 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.465 -0.772 . . . . 0.0 109.737 177.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.7 OUTLIER -69.8 -45.38 68.06 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -49.98 -39.15 40.08 Favored 'General case' 0 N--CA 1.512 2.64 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.903 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -73.56 -39.26 64.82 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.687 -1.258 . . . . 0.0 110.162 177.19 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.05 -52.87 63.9 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.291 -0.881 . . . . 0.0 108.728 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.678 ' HB ' HD13 ' A' ' 84' ' ' LEU . 3.4 m -69.17 -60.54 2.28 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.826 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 1.012 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.5 t -53.32 -32.86 50.96 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 120.782 -1.199 . . . . 0.0 108.367 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' LYS . . . 110.49 -38.59 3.23 Favored Glycine 0 N--CA 1.493 2.488 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.109 178.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 127' ' ' THR . 1.8 mpp? -155.26 49.65 0.56 Allowed 'General case' 0 N--CA 1.516 2.838 0 CA-C-N 123.198 3.499 . . . . 0.0 116.095 -179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.016 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.17 83.25 0.58 Allowed Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 120.088 -1.633 . . . . 0.0 110.369 177.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.903 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.9 Cg_endo -69.64 -111.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 122.66 0.821 . . . . 0.0 113.576 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.758 ' HD2' ' H71' ' C' ' 224' ' ' ' DT' . 0.7 OUTLIER -60.43 -19.04 54.81 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 121.019 -1.051 . . . . 0.0 110.661 -177.328 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.891 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.7 -38.55 80.36 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.002 -1.061 . . . . 0.0 108.706 177.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.016 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.58 -40.6 95.83 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.399 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.562 ' HG2' HD23 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -56.58 -40.59 75.49 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.738 -0.785 . . . . 0.0 108.908 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.432 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . 34.7 tt0 -66.93 -51.6 53.22 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.825 . . . . 0.0 109.753 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.507 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -53.01 -42.88 66.04 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.183 -0.948 . . . . 0.0 109.311 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.715 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.271 0.1 OUTLIER -54.69 -53.88 49.16 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 122.522 1.153 . . . . 0.0 108.574 177.269 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.453 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 62.5 ttp85 -63.14 -12.12 25.34 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.76 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -84.9 -53.95 4.98 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.003 -1.061 . . . . 0.0 109.064 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -100.92 -48.78 4.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.278 -0.889 . . . . 0.0 111.634 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.66 ' O ' ' HB3' ' A' ' 95' ' ' GLU . 5.9 ttt85 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.375 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.393 1 C3'-C2'-C1' 114.849 8.678 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.536 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.607 3 C3'-C2'-C1' 113.686 7.847 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.536 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 115.262 8.973 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.567 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.455 1 C3'-C2'-C1' 115.072 8.837 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.567 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 114.75 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.487 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.113 2 C3'-C2'-C1' 114.191 8.208 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.617 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.965 1 C3'-C2'-C1' 114.17 8.193 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.617 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.914 8.724 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.491 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.017 2 C3'-C2'-C1' 114.749 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.602 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.929 1 C3'-C2'-C1' 115.34 9.029 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.669 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.116 2 C3'-C2'-C1' 114.734 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.753 " O5'" ' H6 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 4 C3'--C2' 1.406 -11.223 1 C3'-C2'-C1' 114.516 8.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.683 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.993 1 C3'-C2'-C1' 114.468 8.406 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.608 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.531 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.513 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.552 2 C3'-C2'-C1' 115.658 9.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.513 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.842 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.77 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.325 2 C3'-C2'-C1' 114.806 8.647 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.438 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.403 -11.453 2 C3'-C2'-C1' 114.33 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.543 H2'' " O5'" ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.972 2 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.543 " O5'" H2'' ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.21 2 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.891 ' OP1' ' HA ' ' A' ' 130' ' ' ALA . . . . . . . . 2 C3'--C2' 1.421 -9.692 2 C3'-C2'-C1' 115.035 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.953 2 C3'-C2'-C1' 114.927 8.734 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.675 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.523 8.445 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.543 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.099 1 C3'-C2'-C1' 115.214 8.939 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.529 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.718 2 C3'-C2'-C1' 114.717 8.583 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.493 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.344 1 C3'-C2'-C1' 114.848 8.677 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.576 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.068 1 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.686 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -10.987 2 C3'-C2'-C1' 114.93 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.686 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.078 8.841 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.942 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.409 -10.939 1 C3'-C2'-C1' 114.703 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.868 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.407 -11.127 2 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.85 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.581 9.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.463 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.304 2 C3'-C2'-C1' 114.805 8.646 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.867 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.295 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.201 0.525 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -114.52 -22.36 9.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.346 -0.846 . . . . 0.0 110.415 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.28 159.35 1.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.154 -0.966 . . . . 0.0 109.776 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 1.04 ' HB3' ' OG1' ' A' ' 8' ' ' THR . . . -122.48 -154.4 0.6 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.088 -1.007 . . . . 0.0 110.594 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.562 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -60.61 25.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.423 -0.798 . . . . 0.0 112.731 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.562 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.6 OUTLIER 79.63 120.8 0.05 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.188 -0.945 . . . . 0.0 110.402 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.776 ' N ' HD22 ' A' ' 7' ' ' LEU . 2.8 mm? 59.81 63.82 1.41 Allowed 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 122.981 1.372 . . . . 0.0 110.203 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 1.04 ' OG1' ' HB3' ' A' ' 4' ' ' ALA . 20.6 m -86.91 66.31 9.37 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 113.847 -1.524 . . . . 0.0 107.99 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.623 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 23.5 p30 -38.91 -28.04 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.27 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 8' ' ' THR . 1.1 m-20 -57.92 -50.43 73.37 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 120.757 -1.215 . . . . 0.0 108.108 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.628 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -75.29 -26.09 58.47 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 117.97 -1.492 . . . . 0.0 108.943 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.876 ' O ' HG23 ' A' ' 16' ' ' VAL . 10.3 mtt180 -54.61 -39.93 68.38 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 177.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.022 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 30.5 t-105 -62.56 -40.95 98.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.628 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.6 tm0? -60.94 -29.81 69.85 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 106.984 -1.488 . . . . 0.0 106.984 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -74.99 -33.64 61.88 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.241 1.02 . . . . 0.0 108.662 177.35 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.876 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.23 -28.43 25.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.623 0 CA-C-O 122.449 1.118 . . . . 0.0 111.387 -179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.022 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.4 mt -94.71 -31.02 13.98 Favored 'General case' 0 C--N 1.262 -3.198 0 CA-C-O 122.235 1.016 . . . . 0.0 108.596 -179.482 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -76.93 -14.16 59.9 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.793 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 3.0 mmt-85 67.12 40.96 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 121.426 -0.797 . . . . 0.0 109.475 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -70.14 110.13 6.15 Favored Pre-proline 0 C--N 1.301 -1.503 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.812 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 47.2 Cg_endo -71.72 6.16 2.14 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.755 1.397 . . . . 0.0 109.915 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.1 t30 -105.44 -11.76 16.29 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 122.004 0.907 . . . . 0.0 109.211 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.18 -5.92 15.2 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.514 1.149 . . . . 0.0 108.016 176.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.783 ' OD1' ' HG3' ' A' ' 39' ' ' ARG . 27.9 t0 -77.81 128.19 33.6 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.537 ' HA3' ' HB2' ' A' ' 78' ' ' ASN . . . 100.45 -31.82 8.08 Favored Glycine 0 N--CA 1.498 2.823 0 N-CA-C 106.611 -2.596 . . . . 0.0 106.611 -177.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 14.8 tp10 -75.76 -49.43 18.2 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.799 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 28.6 p90 -140.32 170.14 16.37 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.259 1.028 . . . . 0.0 110.524 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.76 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -126.47 175.71 8.08 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.848 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.42 121.94 16.21 Favored 'General case' 0 C--N 1.28 -2.437 0 C-N-CA 118.267 -1.373 . . . . 0.0 109.038 176.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.581 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.67 114.27 27.24 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.525 -175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.916 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.36 112.83 24.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.268 46.3 mtm180 -70.06 -20.03 63.25 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.91 0.862 . . . . 0.0 111.309 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.916 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -66.87 -33.58 75.9 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 121.695 0.759 . . . . 0.0 109.13 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.7 t -115.22 2.35 14.04 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.755 -0.778 . . . . 0.0 110.26 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.78 73.94 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.015 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 50.5 mt -123.49 163.68 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.24 -1.153 . . . . 0.0 109.275 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.726 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 5.6 p90 -143.1 118.17 10.08 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.512 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.783 ' HG3' ' OD1' ' A' ' 24' ' ' ASP 0.317 0.0 OUTLIER -82.0 164.69 47.29 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.03 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.746 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.2 Cg_endo -65.62 -16.75 54.92 Favored 'Trans proline' 0 C--N 1.293 -2.384 0 O-C-N 123.046 1.024 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.6 p -115.27 30.82 7.1 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.707 -1.246 . . . . 0.0 112.258 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.457 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.1 t -46.33 139.67 4.64 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.887 -1.133 . . . . 0.0 110.581 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.79 1.17 39.96 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.122 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.67 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.2 -50.91 5.72 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.607 -1.308 . . . . 0.0 112.461 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.66 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.42 177.96 0.13 Allowed 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.205 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.848 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.0 m-70 -140.05 158.01 44.74 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.392 -1.442 . . . . 0.0 114.866 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.626 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.17 159.71 24.36 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.95 177.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.1 mt -56.09 159.5 3.34 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.264 -0.897 . . . . 0.0 111.745 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 13.6 ttp180 -62.69 -30.21 71.23 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.835 1.302 . . . . 0.0 108.576 178.614 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.3 OUTLIER -38.36 -63.79 0.47 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 114.017 -1.447 . . . . 0.0 111.811 -179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.6 m-20 -92.19 17.18 9.98 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 121.651 0.738 . . . . 0.0 109.076 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -112.92 130.69 66.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 O-C-N 121.573 -0.705 . . . . 0.0 111.407 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.848 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -125.77 175.26 7.75 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.61 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.8 m-85 -121.43 150.3 41.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.087 -1.008 . . . . 0.0 111.672 -178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.76 ' HB2' HG22 ' A' ' 28' ' ' VAL . 22.8 m-85 -132.66 154.74 49.83 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.534 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -72.29 -39.73 68.1 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.502 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.9 p30 -137.75 162.42 33.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 122.757 1.265 . . . . 0.0 110.799 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.764 ' HB1' HE22 ' A' ' 73' ' ' GLN . . . -63.14 -22.85 67.14 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.564 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.592 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 5.0 t -72.28 -36.4 68.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.578 -1.326 . . . . 0.0 108.819 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.7 tp10 -61.96 -49.36 76.44 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 177.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.708 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.71 -44.26 93.77 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 63.1 mt -62.6 -26.4 68.58 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.1 -17.94 51.24 Favored 'General case' 0 C--N 1.311 -1.101 0 O-C-N 121.742 -0.599 . . . . 0.0 110.229 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.41 0.22 23.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.193 -0.942 . . . . 0.0 110.194 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.62 33.9 17.77 Favored Glycine 0 C--N 1.285 -2.255 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 11.3 m-85 -106.81 161.56 14.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.209 -1.171 . . . . 0.0 111.986 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -99.81 116.49 64.7 Favored Pre-proline 0 C--N 1.299 -1.59 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.633 ' HG3' HD21 ' A' ' 62' ' ' LEU . 27.9 Cg_endo -60.61 149.92 84.68 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 O-C-N 123.569 1.3 . . . . 0.0 111.455 -178.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.782 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 8.1 t -76.56 115.95 16.78 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.466 0.651 . . . . 0.0 109.403 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -49.79 -8.84 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.679 -0.638 . . . . 0.0 112.135 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -108.8 -37.12 5.96 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 122.191 0.996 . . . . 0.0 109.301 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 6.7 m -86.0 -13.63 46.95 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.814 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.764 HE22 ' HB1' ' A' ' 58' ' ' ALA . 11.6 tp60 -84.52 -47.69 0.67 Allowed Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 118.751 -1.18 . . . . 0.0 109.022 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.2 Cg_endo -91.75 24.36 0.54 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 N-CA-C 108.374 -1.433 . . . . 0.0 108.374 175.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.714 ' HB3' ' HA ' ' A' ' 72' ' ' CYS . 14.3 p-10 -74.92 178.55 5.49 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.365 1.079 . . . . 0.0 113.791 -177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -115.02 74.13 0.86 Allowed 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.411 177.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.752 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -87.31 -129.65 0.06 Allowed 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.62 -0.675 . . . . 0.0 110.004 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.011 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.3 m120 -60.64 -30.79 7.57 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.61 -1.931 . . . . 0.0 108.064 176.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.011 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.8 Cg_endo -61.12 -18.36 57.7 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 N-CA-C 107.717 -1.686 . . . . 0.0 107.717 175.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -50.39 -62.79 1.38 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.485 -0.759 . . . . 0.0 109.105 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -50.34 -34.74 24.9 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.508 -0.745 . . . . 0.0 111.481 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -69.37 -44.79 70.82 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.121 -0.987 . . . . 0.0 110.061 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.59 -27.24 66.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.908 -1.12 . . . . 0.0 109.268 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.996 HD21 ' HA ' ' A' ' 124' ' ' THR . 2.1 tp -77.88 -29.94 50.53 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 118.771 -1.172 . . . . 0.0 108.124 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.13 -37.72 86.22 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.854 ' HE3' HD13 ' A' ' 105' ' ' LEU . 5.2 tmtm? -57.69 -51.23 70.38 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 121.499 0.666 . . . . 0.0 109.322 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.727 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mm -52.46 -45.29 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.19 -0.944 . . . . 0.0 110.787 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 15.5 m -50.95 -45.42 60.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.583 -1.323 . . . . 0.0 107.867 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -55.56 -39.45 70.64 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 176.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.792 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.96 -37.92 67.1 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.669 ' HA ' ' HG2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -62.48 -48.89 77.59 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.005 -1.078 . . . . 0.0 108.543 178.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.56 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.5 tpt180 -51.72 -50.99 59.48 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.483 -0.76 . . . . 0.0 109.603 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.413 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 1.8 mm? -56.43 -38.86 72.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.502 -0.749 . . . . 0.0 111.016 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.8 HD22 ' OE1' ' A' ' 132' ' ' GLN . 0.2 OUTLIER -69.27 -10.27 57.02 Favored 'General case' 0 N--CA 1.504 2.231 0 CA-C-O 121.661 0.743 . . . . 0.0 110.11 -178.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.436 ' HB2' ' HG3' ' A' ' 136' ' ' ARG . 4.2 tp10 -129.66 -4.01 4.72 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 92' ' ' ARG . 5.4 tt0 -82.31 -52.6 6.77 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.422 -0.799 . . . . 0.0 109.462 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.668 ' HG2' ' N ' ' A' ' 98' ' ' THR . 0.0 OUTLIER -87.21 -155.93 0.31 Allowed 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 118.246 -1.381 . . . . 0.0 109.677 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.668 ' N ' ' HG2' ' A' ' 97' ' ' GLU . 2.3 m -103.32 -70.05 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.599 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.54 139.99 60.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 N-CA-C 108.337 -1.447 . . . . 0.0 108.337 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.573 HG11 HD23 ' A' ' 94' ' ' LEU . 2.3 t -78.47 135.73 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 120.692 -1.255 . . . . 0.0 108.945 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.47 114.16 4.65 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.718 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 102' ' ' LEU . 3.6 pp -116.04 10.03 14.97 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.6 -45.57 2.35 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.969 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.35 -42.31 96.29 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.854 HD13 ' HE3' ' A' ' 86' ' ' LYS . 49.1 tp -69.41 -30.46 68.41 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.58 178.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.636 ' HB2' ' CD1' ' A' ' 102' ' ' LEU . . . -71.59 -43.3 66.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.315 -0.866 . . . . 0.0 108.886 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.08 -32.02 73.43 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.55 -0.719 . . . . 0.0 109.551 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -70.21 -52.91 19.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.479 -0.763 . . . . 0.0 110.095 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.784 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 22.0 t -69.82 -16.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.338 -0.851 . . . . 0.0 110.39 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.71 29.64 0.29 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.565 -0.709 . . . . 0.0 110.355 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.477 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 13.2 ptp -140.07 173.84 11.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.28 -0.888 . . . . 0.0 111.047 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.429 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.8 OUTLIER -73.23 170.61 13.16 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.588 -0.695 . . . . 0.0 110.924 -179.655 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.831 ' HA ' HD11 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.08 -38.02 48.66 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.662 1.348 . . . . 0.0 110.352 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.584 ' CE2' ' H72' ' C' ' 223' ' ' ' DT' . 9.4 m-30 -69.43 -38.56 77.91 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 117.881 -1.528 . . . . 0.0 109.35 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.924 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.69 -23.7 62.53 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 116.418 -2.113 . . . . 0.0 110.792 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.657 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.3 tm? -65.21 -40.67 94.47 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 75.6 m-70 -61.17 -41.15 96.27 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.582 ' HG2' ' O ' ' A' ' 114' ' ' PHE . 58.0 mmt-85 -57.49 -37.92 73.72 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.09 -1.006 . . . . 0.0 109.31 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.1 OUTLIER -66.6 -47.94 71.1 Favored 'General case' 0 N--CA 1.515 2.795 0 O-C-N 120.94 -1.1 . . . . 0.0 109.065 177.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 87' ' ' ILE 0.268 0.4 OUTLIER -49.81 -40.07 40.51 Favored 'General case' 0 N--CA 1.514 2.765 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.446 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.7 tttp -74.23 -39.78 62.84 Favored 'General case' 0 N--CA 1.514 2.734 0 O-C-N 121.168 -0.957 . . . . 0.0 110.012 177.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.01 51.39 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.441 -0.787 . . . . 0.0 108.964 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.666 HG22 HD22 ' A' ' 84' ' ' LEU . 25.4 m -68.64 -60.39 2.45 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 119.779 -0.768 . . . . 0.0 110.374 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.996 ' HA ' HD21 ' A' ' 84' ' ' LEU . 2.6 t -51.01 -32.92 22.91 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.69 -1.256 . . . . 0.0 108.122 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.626 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.57 -40.34 2.58 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 118.268 -1.295 . . . . 0.0 113.986 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 11.2 mmm -158.4 48.28 0.36 Allowed 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 122.536 3.168 . . . . 0.0 114.55 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.787 HG22 ' HB3' ' A' ' 130' ' ' ALA . 1.4 m -171.3 93.22 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.317 -1.489 . . . . 0.0 110.397 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.623 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.9 Cg_endo -66.75 -109.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 122.563 0.77 . . . . 0.0 112.613 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.95 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.5 OUTLIER -59.63 -21.97 61.2 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.871 -1.143 . . . . 0.0 110.671 -178.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.83 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.72 -43.8 75.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.847 -1.158 . . . . 0.0 109.261 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.1 OUTLIER -64.9 -27.86 69.14 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 117.625 -1.63 . . . . 0.0 109.671 176.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.8 ' OE1' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -63.11 -43.95 97.03 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -65.83 -46.21 79.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.81 -0.556 . . . . 0.0 109.982 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.09 -58.4 7.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.227 -0.921 . . . . 0.0 109.27 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 135' ' ' TRP . 0.0 OUTLIER -46.11 -48.36 17.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 122.003 0.906 . . . . 0.0 109.457 177.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.47 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 9.7 ttt-85 -61.9 -31.54 71.84 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.07 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -77.81 -29.89 50.9 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.26 -0.9 . . . . 0.0 110.77 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -100.23 -20.35 15.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.326 -0.859 . . . . 0.0 109.977 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.069 -1.02 . . . . 0.0 110.292 179.727 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.53 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.404 -11.366 1 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.53 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.611 2 C3'-C2'-C1' 113.622 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.523 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.534 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.251 1 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.534 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.566 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.51 " H2'" ' H71' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.007 2 C3'-C2'-C1' 114.173 8.195 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.593 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.973 1 C3'-C2'-C1' 114.171 8.194 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.593 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.103 2 C3'-C2'-C1' 114.917 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.445 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.083 2 C3'-C2'-C1' 114.695 8.568 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.572 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.746 1 C3'-C2'-C1' 115.117 8.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.572 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.752 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.924 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.406 -11.206 1 C3'-C2'-C1' 114.542 8.459 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.667 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.572 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.644 2 C3'-C2'-C1' 114.807 8.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.578 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.138 2 C3'-C2'-C1' 115.718 9.299 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.578 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.617 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.722 8.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.756 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.405 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.178 2 C3'-C2'-C1' 114.344 8.317 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.587 " H2'" ' H71' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.089 2 C3'-C2'-C1' 114.488 8.42 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.587 ' H71' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.95 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.327 1 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.539 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.237 1 C3'-C2'-C1' 115.075 8.839 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.539 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.954 1 C3'-C2'-C1' 114.437 8.384 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.507 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.109 1 C3'-C2'-C1' 115.31 9.007 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.507 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.675 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.475 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.554 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.535 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.863 1 C3'-C2'-C1' 114.794 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.623 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.88 2 C3'-C2'-C1' 114.831 8.665 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.623 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.328 2 C3'-C2'-C1' 114.899 8.713 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.782 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.408 -11.046 2 C3'-C2'-C1' 114.559 8.471 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 1.015 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.698 2 C3'-C2'-C1' 114.683 8.559 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.717 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.552 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.695 2 C3'-C2'-C1' 114.508 8.434 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.398 2 C3'-C2'-C1' 114.329 8.307 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 tpt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.209 0.528 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 53.66 95.96 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.407 -0.808 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -107.58 155.21 20.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.344 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.14 -162.19 0.07 Allowed 'General case' 0 N--CA 1.485 1.325 0 O-C-N 121.203 -0.935 . . . . 0.0 109.603 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.521 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -72.28 50.83 0.23 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.191 -0.943 . . . . 0.0 110.714 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 5' ' ' THR . 21.2 m 79.41 71.73 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 175.57 37.85 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.368 -0.832 . . . . 0.0 110.457 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.675 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.0 m -79.83 63.82 4.49 Favored 'General case' 0 C--N 1.296 -1.724 0 C-N-CA 118.876 -1.13 . . . . 0.0 109.082 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.447 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 2.6 p30 -53.2 -26.25 16.84 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 177.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 16.7 m-20 -57.19 -44.81 83.95 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -80.81 -31.55 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 117.56 -1.656 . . . . 0.0 109.216 178.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.807 ' O ' HG23 ' A' ' 16' ' ' VAL . 11.6 mmt180 -52.94 -41.77 64.79 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 104.74 -2.318 . . . . 0.0 104.74 176.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.026 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.1 t-105 -61.6 -40.53 95.14 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.25 -34.13 73.28 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.64 -32.69 71.51 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.155 0.978 . . . . 0.0 108.506 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 12' ' ' ARG . 50.2 t -73.41 -34.44 43.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 CA-C-O 122.19 0.995 . . . . 0.0 111.812 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.026 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.251 2.2 mt -89.22 -32.03 17.62 Favored 'General case' 0 C--N 1.263 -3.18 0 CA-C-O 122.255 1.026 . . . . 0.0 108.769 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.63 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -79.04 -11.86 60.01 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.904 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.701 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.4 OUTLIER 60.31 40.97 17.04 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.081 0.943 . . . . 0.0 110.082 -179.176 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 22' ' ' ASN . 42.3 t0 -67.68 110.21 5.03 Favored Pre-proline 0 C--N 1.3 -1.586 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.6 Cg_endo -67.96 6.39 0.83 Allowed 'Trans proline' 0 C--N 1.308 -1.576 0 O-C-N 123.7 1.368 . . . . 0.0 109.908 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.298 1.3 t30 -101.45 -11.4 19.37 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.867 0.842 . . . . 0.0 109.316 -178.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.691 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.45 -5.86 15.64 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.101 0.953 . . . . 0.0 108.461 177.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.869 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.6 t0 -79.89 127.52 32.34 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.799 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -25.02 29.89 Favored Glycine 0 N--CA 1.506 3.322 0 N-CA-C 106.364 -2.694 . . . . 0.0 106.364 -176.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 56' ' ' ALA . 5.7 tp10 -90.2 -49.22 6.68 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.709 -0.877 . . . . 0.0 110.116 179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.691 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.1 p90 -141.18 170.34 15.92 Favored 'General case' 0 N--CA 1.502 2.162 0 CA-C-O 122.269 1.033 . . . . 0.0 111.002 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.738 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -127.84 175.79 8.88 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.82 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.85 121.62 16.46 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 118.288 -1.365 . . . . 0.0 108.997 176.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.561 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -99.35 114.59 27.56 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.992 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -90.16 108.98 20.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.687 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 18.5 mtm180 -68.43 -19.99 64.62 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.883 0.849 . . . . 0.0 111.227 -178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.992 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.46 -33.7 76.28 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.646 0.736 . . . . 0.0 109.166 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.3 t -114.99 3.21 14.44 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.339 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.37 33.21 74.97 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.985 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 47.9 mt -122.68 163.79 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.208 -1.172 . . . . 0.0 109.552 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 4.4 p90 -145.66 118.07 8.49 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 175.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.53 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.75 ' HD2' ' HB2' ' A' ' 77' ' ' ALA 0.297 1.3 mtm180 -85.0 177.94 2.66 Favored Pre-proline 0 C--N 1.284 -2.276 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 177.894 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.722 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.6 Cg_endo -74.18 -11.36 23.09 Favored 'Trans proline' 0 C--N 1.291 -2.484 0 O-C-N 122.772 0.88 . . . . 0.0 110.801 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.701 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.2 p -115.37 30.71 7.18 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 120.605 -1.309 . . . . 0.0 113.034 -178.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.485 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 46.4 t -60.35 125.47 23.78 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.578 -1.326 . . . . 0.0 109.202 177.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.561 ' NE ' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.36 16.06 26.81 Favored 'General case' 0 C--N 1.283 -2.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.71 179.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.62 -50.67 6.12 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.72 -1.237 . . . . 0.0 111.976 -178.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.648 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 176.6 168.7 0.49 Allowed 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.685 ' HE1' HG12 ' A' ' 16' ' ' VAL . 5.5 m-70 -140.19 160.29 40.29 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.008 -1.683 . . . . 0.0 114.512 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.35 158.82 25.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.208 176.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.32 162.84 1.34 Allowed 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.057 -1.027 . . . . 0.0 111.945 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.269 22.6 ttp85 -64.46 -30.28 71.32 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 122.836 1.303 . . . . 0.0 108.64 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.44 -62.2 0.62 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 113.997 -1.456 . . . . 0.0 112.154 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.782 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -91.56 17.18 9.07 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.709 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -113.19 125.98 70.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 O-C-N 121.624 -0.672 . . . . 0.0 111.533 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.82 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.4 p -122.69 175.19 6.65 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 86.7 m-85 -123.39 150.29 43.93 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.069 -1.019 . . . . 0.0 111.379 -178.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.738 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.4 m-85 -130.91 154.81 47.71 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.102 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.63 -39.82 76.91 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.6 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.3 p30 -138.26 162.65 33.78 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 122.576 1.179 . . . . 0.0 110.802 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.64 -23.23 67.29 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.974 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.4 t -71.31 -36.91 71.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.711 -1.243 . . . . 0.0 109.05 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.49 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 23.2 tp10 -61.78 -49.35 76.73 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.732 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.21 -43.84 92.28 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.761 HD21 ' HG3' ' A' ' 68' ' ' PRO . 62.9 mt -61.46 -27.87 68.87 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.8 -17.24 53.83 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 121.561 -0.712 . . . . 0.0 110.04 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.74 0.22 24.41 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.352 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.88 35.71 15.22 Favored Glycine 0 C--N 1.284 -2.325 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 10.7 m-85 -111.68 160.85 16.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.312 -1.111 . . . . 0.0 111.245 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -99.78 119.69 59.13 Favored Pre-proline 0 C--N 1.3 -1.555 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.2 Cg_endo -64.07 135.72 48.8 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 O-C-N 123.507 1.267 . . . . 0.0 110.517 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.809 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 4.0 t -56.25 121.33 9.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.598 0.713 . . . . 0.0 110.04 -178.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.6 OUTLIER -64.41 10.72 0.06 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.37 0.605 . . . . 0.0 111.676 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.568 ' NH2' ' O2 ' ' C' ' 231' ' ' ' DT' 0.256 4.5 ttm180 -123.25 -30.44 3.71 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 122.196 0.998 . . . . 0.0 108.535 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 3.9 m -93.87 -29.79 15.13 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.349 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -79.93 -41.39 1.41 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.578 -0.701 . . . . 0.0 111.778 -178.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.526 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 44.1 Cg_endo -76.55 -28.71 6.49 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 122.87 0.932 . . . . 0.0 110.779 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.7 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -82.33 178.26 8.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 109.771 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -100.74 138.99 37.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.052 -1.03 . . . . 0.0 112.909 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -96.25 -115.96 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.029 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.7 m120 -61.92 -30.79 6.77 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 119.62 -1.925 . . . . 0.0 108.121 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.029 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.7 Cg_endo -61.38 -19.38 63.98 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 N-CA-C 108.017 -1.57 . . . . 0.0 108.017 176.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 12.5 ttt180 -54.69 -62.95 1.32 Allowed 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.02 -34.19 20.54 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.418 -0.801 . . . . 0.0 111.552 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 78.5 t60 -68.84 -42.25 77.43 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.138 -0.976 . . . . 0.0 109.204 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -67.91 -23.44 65.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.996 -1.065 . . . . 0.0 108.827 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.084 HD22 HG22 ' A' ' 123' ' ' THR . 0.1 OUTLIER -77.6 -32.46 53.58 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.1 m-20 -61.89 -37.45 84.63 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -57.13 -49.04 77.15 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.453 0.644 . . . . 0.0 110.136 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.81 -40.19 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.872 -1.143 . . . . 0.0 110.756 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.907 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 28.6 m -53.97 -40.87 67.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.021 -1.674 . . . . 0.0 107.513 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.68 -39.31 76.83 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 176.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 1.028 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.98 -32.67 61.83 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.907 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -61.83 -55.13 33.16 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 178.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.488 ' HA ' ' OXT' ' A' ' 139' ' ' ARG . 5.1 ttt180 -50.23 -53.26 29.4 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.495 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.761 HD13 ' OE1' ' A' ' 97' ' ' GLU . 2.7 mm? -56.18 -37.42 69.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.537 -0.727 . . . . 0.0 111.498 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.028 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.3 mt -69.38 -10.5 58.24 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.92 -0.488 . . . . 0.0 110.684 -178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.772 ' HB3' ' OXT' ' A' ' 139' ' ' ARG . 7.5 tm-20 -129.92 -8.43 4.43 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.232 -0.918 . . . . 0.0 110.033 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -90.26 -48.81 6.92 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.33 -0.856 . . . . 0.0 112.07 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.761 ' OE1' HD13 ' A' ' 93' ' ' LEU . 1.8 pt-20 -87.5 -155.86 0.31 Allowed 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 117.829 -1.548 . . . . 0.0 111.29 -178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.617 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 4.1 m -105.37 -63.55 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 109.321 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.617 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.7 Cg_endo -65.12 141.51 70.01 Favored 'Trans proline' 0 N--CA 1.49 1.303 0 N-CA-C 108.947 -1.213 . . . . 0.0 108.947 174.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.667 HG13 HD23 ' A' ' 94' ' ' LEU . 26.1 t -77.5 154.45 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.638 -1.289 . . . . 0.0 110.555 -177.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.438 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -117.07 99.3 6.97 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 122.656 1.217 . . . . 0.0 112.851 -177.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -131.93 -36.62 1.18 Allowed 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 105.558 -2.016 . . . . 0.0 105.558 177.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -38.83 -45.53 1.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.41 -38.76 74.68 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.356 -1.465 . . . . 0.0 109.955 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.85 HD22 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -73.97 -39.72 63.51 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.276 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.41 -35.95 78.4 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.171 -0.955 . . . . 0.0 109.639 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -39.24 81.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.394 0.616 . . . . 0.0 109.445 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.78 -56.05 20.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.357 -0.839 . . . . 0.0 110.08 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.755 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 31.1 t -70.47 -23.74 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.39 -0.819 . . . . 0.0 110.596 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 81.78 31.81 0.12 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.937 -0.477 . . . . 0.0 112.003 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.803 ' HE1' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.99 -174.98 4.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 118.436 -1.306 . . . . 0.0 111.732 178.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.509 ' O ' ' HE3' ' A' ' 111' ' ' MET . 1.9 p -72.74 166.11 45.83 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.308 -0.87 . . . . 0.0 113.258 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.33 -31.44 52.64 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.103 1.869 . . . . 0.0 111.539 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 12.2 m-30 -69.3 -40.07 77.9 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 118.339 -1.345 . . . . 0.0 108.805 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.78 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 5.3 t-80 -70.67 -27.65 64.19 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 117.037 -1.865 . . . . 0.0 110.941 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.85 HD11 HD22 ' A' ' 105' ' ' LEU . 1.8 tm? -61.81 -42.25 98.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 176.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.579 ' ND1' ' HD3' ' A' ' 129' ' ' LYS . 27.4 m170 -62.62 -41.55 99.07 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.616 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -59.47 -35.18 73.59 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.426 -0.796 . . . . 0.0 109.395 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.2 tm? -69.86 -46.74 64.89 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.12 -0.988 . . . . 0.0 109.158 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.602 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.4 OUTLIER -49.92 -40.21 42.59 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.864 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 4.5 tttt -72.34 -42.57 65.21 Favored 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.856 -1.153 . . . . 0.0 110.112 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.97 -56.81 16.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.403 -0.811 . . . . 0.0 109.317 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 1.084 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.21 -60.58 2.25 Favored 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.531 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.724 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -51.03 -32.91 23.1 Favored 'General case' 0 N--CA 1.518 2.951 0 O-C-N 120.611 -1.306 . . . . 0.0 108.327 177.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.56 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.69 -35.1 4.99 Favored Glycine 0 N--CA 1.495 2.586 0 CA-C-O 117.691 -1.616 . . . . 0.0 115.334 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.56 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -160.41 49.31 0.27 Allowed 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 123.412 3.606 . . . . 0.0 116.311 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.012 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.34 81.61 0.58 Allowed Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 120.058 -1.651 . . . . 0.0 110.591 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.864 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.6 Cg_endo -70.31 -110.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 118.318 -0.655 . . . . 0.0 113.086 -178.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.99 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -20.19 56.83 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.925 -1.109 . . . . 0.0 111.368 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.807 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.65 -40.32 80.28 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.951 -1.093 . . . . 0.0 108.758 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.012 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.75 -39.29 93.38 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.318 177.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.687 ' HG2' HD22 ' A' ' 94' ' ' LEU . 3.0 tt0 -57.5 -37.54 73.14 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.01 178.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -69.41 -52.49 26.44 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.465 -0.772 . . . . 0.0 109.583 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.64 -43.26 65.33 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.29 -0.881 . . . . 0.0 109.09 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.765 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.283 0.1 OUTLIER -52.64 -54.6 31.11 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 122.472 1.13 . . . . 0.0 108.87 177.348 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.64 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 8.5 ttp180 -64.94 -11.53 39.35 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.115 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -87.98 -50.23 6.55 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.332 -0.855 . . . . 0.0 109.759 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -101.21 -48.5 4.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.241 -0.912 . . . . 0.0 112.376 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.772 ' OXT' ' HB3' ' A' ' 95' ' ' GLU . 17.8 ttp85 . . . . . 0 N--CA 1.496 1.874 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.758 -177.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.517 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.161 1 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.517 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.584 3 C3'-C2'-C1' 113.67 7.836 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.508 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.322 2 C3'-C2'-C1' 115.146 8.89 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.167 1 C3'-C2'-C1' 115.138 8.884 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.584 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.559 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.6 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.09 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.411 -10.742 2 C3'-C2'-C1' 114.183 8.202 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.215 2 C3'-C2'-C1' 114.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.461 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.133 2 C3'-C2'-C1' 114.802 8.644 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.599 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.755 1 C3'-C2'-C1' 115.209 8.935 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.599 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.955 2 C3'-C2'-C1' 114.642 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.78 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.561 1 C3'-C2'-C1' 114.639 8.528 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.411 -10.667 1 C3'-C2'-C1' 114.402 8.359 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.581 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.744 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.498 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.36 2 C3'-C2'-C1' 115.623 9.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.498 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.896 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.7 2 C3'-C2'-C1' 114.645 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.375 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.495 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.235 2 C3'-C2'-C1' 114.461 8.4 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.612 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.314 2 C3'-C2'-C1' 114.583 8.488 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.682 " H3'" ' HG2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.42 -9.756 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.99 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.367 1 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.421 -9.745 1 C3'-C2'-C1' 114.835 8.668 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.588 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.417 -10.073 2 C3'-C2'-C1' 114.596 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.575 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.951 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.493 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.841 2 C3'-C2'-C1' 114.757 8.612 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.473 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.508 1 C3'-C2'-C1' 114.892 8.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.549 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.999 1 C3'-C2'-C1' 114.816 8.654 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.613 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.874 2 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.613 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.205 2 C3'-C2'-C1' 114.976 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.809 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.423 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.985 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.834 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.854 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.69 1 C3'-C2'-C1' 115.539 9.171 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.466 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.38 2 C3'-C2'-C1' 114.834 8.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.406 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.412 -10.639 2 C3'-C2'-C1' 114.609 8.506 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.406 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.351 2 C3'-C2'-C1' 114.259 8.256 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.415 ' O ' ' N ' ' A' ' 3' ' ' LYS . 3.4 mtm . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.178 0.513 . . . . 0.0 110.144 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.65 -72.44 0.06 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.51 -0.743 . . . . 0.0 110.658 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 1' ' ' MET . 7.6 mtmt -157.29 114.87 3.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.967 -1.083 . . . . 0.0 110.645 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -74.67 -154.89 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.262 -0.899 . . . . 0.0 109.105 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.575 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 m -70.33 41.47 0.05 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.104 -0.997 . . . . 0.0 110.876 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 5' ' ' THR . 33.1 m 79.35 53.81 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.786 -0.571 . . . . 0.0 109.951 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.569 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -147.47 1.19 0.71 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.354 -0.841 . . . . 0.0 111.954 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.752 HG22 ' H ' ' A' ' 11' ' ' GLN . 63.5 m -80.23 64.5 5.07 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 120.597 -1.315 . . . . 0.0 108.613 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.3 p-10 -40.92 -29.99 0.12 Allowed 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.433 0.635 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' THR . 7.4 m-20 -59.77 -52.88 63.57 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.612 -0.68 . . . . 0.0 110.051 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.752 ' H ' HG22 ' A' ' 8' ' ' THR . 0.2 OUTLIER -84.26 -30.9 25.28 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 117.296 -1.761 . . . . 0.0 109.725 178.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.921 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -49.78 -42.12 45.9 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 177.064 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.046 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 25.4 t-105 -66.55 -40.69 89.18 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.375 177.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.527 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -58.55 -34.02 70.57 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.459 -1.296 . . . . 0.0 107.889 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.3 m -71.17 -32.8 69.35 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.025 0.917 . . . . 0.0 108.575 177.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 12' ' ' ARG . 40.3 t -69.85 -35.05 63.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 CA-C-O 122.47 1.129 . . . . 0.0 111.442 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.046 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 2.1 mt -89.03 -33.25 17.23 Favored 'General case' 0 C--N 1.259 -3.332 0 CA-C-O 122.312 1.053 . . . . 0.0 108.384 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.647 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -80.3 -4.14 52.16 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.097 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.647 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 53.19 40.9 31.99 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.963 0.887 . . . . 0.0 110.295 -179.076 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.7 t0 -70.1 110.04 5.96 Favored Pre-proline 0 C--N 1.299 -1.622 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.341 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.8 Cg_endo -68.9 6.39 1.05 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.623 1.328 . . . . 0.0 109.952 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 78' ' ' ASN 0.298 1.1 t30 -102.28 -11.38 18.75 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.841 0.829 . . . . 0.0 109.123 -178.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -105.96 -5.84 19.29 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.825 ' C ' ' HB1' ' A' ' 77' ' ' ALA 0.255 30.6 t0 -75.33 125.96 30.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 179.47 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.815 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.77 -33.42 6.42 Favored Glycine 0 N--CA 1.506 3.349 0 N-CA-C 107.068 -2.413 . . . . 0.0 107.068 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 56' ' ' ALA . 7.2 tp10 -77.28 -45.26 26.9 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 121.771 -0.841 . . . . 0.0 109.516 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 6.7 p90 -148.32 170.79 17.16 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.382 1.087 . . . . 0.0 111.006 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.814 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.04 175.65 9.29 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.48 119.83 13.87 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 117.719 -1.592 . . . . 0.0 108.963 176.062 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.52 113.56 25.28 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 114.601 -1.182 . . . . 0.0 113.335 -175.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.085 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.01 103.06 13.6 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 177.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.271 78.8 mtm180 -63.84 -19.94 65.42 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.902 0.858 . . . . 0.0 111.43 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.085 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.13 -30.64 71.17 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-O 121.866 0.841 . . . . 0.0 108.999 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.576 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.4 t -119.66 2.36 11.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.472 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 61.03 35.19 90.37 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.908 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 60.0 mt -124.32 165.79 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.215 -1.168 . . . . 0.0 109.234 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 -147.58 116.46 6.79 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 175.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.495 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.772 ' HG2' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -93.1 178.23 1.7 Allowed Pre-proline 0 C--N 1.289 -2.063 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.0 Cg_endo -67.59 -19.83 47.82 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 O-C-N 123.087 1.046 . . . . 0.0 112.376 -178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 6.1 p -113.81 31.03 6.81 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.648 -1.283 . . . . 0.0 113.232 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 53.2 t -49.76 137.72 15.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.79 -1.194 . . . . 0.0 110.119 178.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.553 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.1 5.34 42.82 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.469 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.681 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -88.61 -51.0 5.92 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.505 -1.372 . . . . 0.0 112.112 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.679 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 16.2 ttm-85 170.57 -179.12 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.893 ' HE1' HG12 ' A' ' 16' ' ' VAL . 6.1 m-70 -139.05 158.65 43.81 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.173 -1.579 . . . . 0.0 113.994 -178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.68 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.16 156.06 31.84 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.049 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -53.69 159.38 1.61 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.203 -0.935 . . . . 0.0 112.458 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.635 ' HD3' ' CD1' ' A' ' 13' ' ' TRP 0.283 0.0 OUTLIER -61.52 -30.43 70.63 Favored 'General case' 0 N--CA 1.498 1.962 0 CA-C-O 122.721 1.248 . . . . 0.0 109.662 178.682 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.275 0.5 OUTLIER -38.46 -61.95 0.64 Allowed 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.67 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.834 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.6 m-80 -93.37 17.4 11.39 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.787 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.26 126.96 72.98 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.95 0 O-C-N 121.497 -0.752 . . . . 0.0 111.662 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.764 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -125.59 175.21 7.72 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 90.0 m-85 -121.12 150.27 41.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.224 1.012 . . . . 0.0 111.501 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.814 ' HB2' HG22 ' A' ' 28' ' ' VAL . 38.1 m-85 -129.42 156.93 43.29 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.691 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.31 -40.07 71.05 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -138.89 166.0 25.61 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 122.272 1.034 . . . . 0.0 110.586 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.18 -24.57 67.73 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.169 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.672 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.25 -36.25 71.71 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.581 -1.325 . . . . 0.0 108.682 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.12 -48.76 80.18 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.788 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.35 -45.53 91.14 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 62.1 mt -60.19 -27.4 67.12 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.87 -18.19 51.33 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 121.632 -0.667 . . . . 0.0 109.998 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.23 0.36 22.24 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.001 0.905 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.98 37.7 12.46 Favored Glycine 0 C--N 1.285 -2.303 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.1 m-85 -113.14 160.46 18.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -1.11 . . . . 0.0 111.534 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -100.02 117.52 63.19 Favored Pre-proline 0 C--N 1.301 -1.525 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.659 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.0 Cg_endo -61.23 138.23 76.01 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 123.554 1.291 . . . . 0.0 110.976 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 3.8 t -61.47 121.11 11.87 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 109.715 -178.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 74' ' ' PRO . 2.6 tppt? -55.1 -2.21 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.706 -0.621 . . . . 0.0 112.227 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -110.08 -36.15 5.93 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.307 1.051 . . . . 0.0 108.644 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 18.5 m -89.16 -11.17 44.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.468 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.648 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -89.67 -46.7 0.41 Allowed Pre-proline 0 C--N 1.3 -1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.92 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.4 Cg_endo -83.23 0.08 9.7 Favored 'Trans proline' 0 C--N 1.314 -1.285 0 O-C-N 123.079 1.042 . . . . 0.0 111.542 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.667 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 31.3 p-10 -94.92 178.12 5.67 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.888 -1.132 . . . . 0.0 110.723 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 26.2 mmmt -109.24 139.39 44.24 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.32 -0.862 . . . . 0.0 110.772 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.825 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -110.43 -130.42 0.3 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.52 -0.738 . . . . 0.0 109.828 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -54.43 -30.29 6.52 Favored Pre-proline 0 N--CA 1.504 2.268 0 O-C-N 120.315 -1.491 . . . . 0.0 110.017 178.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 50.6 Cg_endo -59.99 -3.16 2.05 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 N-CA-C 106.625 -2.106 . . . . 0.0 106.625 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.807 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -41.51 -61.69 1.01 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.402 0.62 . . . . 0.0 109.352 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -55.06 -35.61 64.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.603 -0.685 . . . . 0.0 112.052 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.76 -46.45 65.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.036 -1.04 . . . . 0.0 110.926 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.402 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.0 tpt85 -67.34 -28.57 68.08 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.357 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -78.02 -29.77 49.62 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.094 -1.442 . . . . 0.0 108.765 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -37.93 83.64 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.79 -1.194 . . . . 0.0 108.011 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.64 -52.92 63.62 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.733 0.778 . . . . 0.0 109.504 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.758 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 18.5 mm -51.28 -45.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.313 -0.867 . . . . 0.0 111.127 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.502 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 23.9 m -50.93 -46.03 60.72 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.463 -1.398 . . . . 0.0 107.778 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -54.96 -39.16 68.63 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.84 -39.95 69.12 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 1.2 t -62.36 -59.99 4.2 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.647 -1.221 . . . . 0.0 108.987 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.469 ' O ' ' CB ' ' A' ' 96' ' ' GLN . 1.8 ttt85 -41.95 -58.02 2.21 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.824 -0.547 . . . . 0.0 110.215 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.607 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 0.3 OUTLIER -56.22 -36.8 68.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.282 -0.886 . . . . 0.0 112.113 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -68.85 -10.79 58.88 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.955 -0.465 . . . . 0.0 112.245 -176.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -143.81 -11.37 0.68 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.977 -1.077 . . . . 0.0 110.996 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' A' ' 92' ' ' ARG . 0.9 OUTLIER -90.23 -34.77 15.66 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.395 -0.815 . . . . 0.0 110.227 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.607 ' OE1' ' O ' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -74.52 -155.69 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.692 -1.203 . . . . 0.0 110.484 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.637 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.13 -71.04 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.637 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.5 Cg_endo -66.03 140.41 59.98 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 N-CA-C 107.809 -1.65 . . . . 0.0 107.809 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.95 134.27 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 120.335 -1.478 . . . . 0.0 107.959 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.73 99.26 8.45 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.435 1.112 . . . . 0.0 111.287 -178.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.693 HD22 ' CB ' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -131.54 -53.04 1.01 Allowed 'General case' 0 C--N 1.288 -2.08 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -40.74 -45.46 2.43 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.149 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.11 -45.19 94.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.928 -1.108 . . . . 0.0 109.802 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.894 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -70.68 -33.67 71.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.199 -0.938 . . . . 0.0 109.446 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -65.92 -47.0 76.18 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.503 -0.748 . . . . 0.0 109.564 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.12 -29.87 69.72 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.459 -0.776 . . . . 0.0 110.482 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -71.61 -39.43 70.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.76 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.2 t -92.28 -9.83 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.223 -0.923 . . . . 0.0 111.025 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.76 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.75 28.84 0.31 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.395 -0.816 . . . . 0.0 110.112 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.737 ' HE3' HG11 ' A' ' 109' ' ' VAL . 2.2 ptp -140.24 163.95 31.39 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.498 -0.751 . . . . 0.0 111.319 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.497 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 2.1 p -73.09 170.84 12.12 Favored Pre-proline 0 N--CA 1.506 2.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.566 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.693 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.2 Cg_endo -61.04 -38.95 64.09 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 O-C-N 123.43 1.226 . . . . 0.0 110.617 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.601 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 11.0 m-30 -69.4 -35.05 75.39 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 118.42 -1.312 . . . . 0.0 109.003 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.88 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.3 t-80 -70.42 -29.72 66.4 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 117.402 -1.719 . . . . 0.0 109.82 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.894 HD21 HD23 ' A' ' 105' ' ' LEU . 0.7 OUTLIER -59.03 -45.1 91.57 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 176.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.516 ' CD2' ' HE2' ' A' ' 129' ' ' LYS . 78.3 m-70 -62.54 -38.67 90.93 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -60.8 -34.56 74.71 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.084 -1.01 . . . . 0.0 109.495 176.645 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -70.02 -45.81 66.43 Favored 'General case' 0 N--CA 1.516 2.827 0 O-C-N 120.956 -1.09 . . . . 0.0 108.566 177.241 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.758 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.314 0.7 OUTLIER -49.76 -40.05 39.75 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 176.725 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.745 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.26 -37.88 57.01 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.07 -1.019 . . . . 0.0 109.883 177.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 121' ' ' LYS . . . -59.36 -55.02 40.05 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.04 -60.23 2.5 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.554 -0.859 . . . . 0.0 110.293 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.889 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -50.66 -32.92 20.56 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.628 -1.295 . . . . 0.0 108.118 176.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.504 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.51 -40.03 2.69 Favored Glycine 0 N--CA 1.492 2.414 0 CA-C-O 118.379 -1.234 . . . . 0.0 114.124 178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.504 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 4.7 mtt -159.18 49.49 0.34 Allowed 'General case' 0 N--CA 1.511 2.623 0 CA-C-N 122.3 3.05 . . . . 0.0 114.945 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.084 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.41 85.07 0.55 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.373 -1.454 . . . . 0.0 110.571 177.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.745 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.1 Cg_endo -69.7 -109.23 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 122.663 0.823 . . . . 0.0 113.114 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.881 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 9.8 tttm -60.17 -22.75 63.29 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.885 -1.134 . . . . 0.0 110.984 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.716 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -41.07 79.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.25 -0.906 . . . . 0.0 109.319 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.084 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.71 -32.11 73.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.538 -1.351 . . . . 0.0 108.679 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -42.92 89.18 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 108.557 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -64.52 -37.71 88.48 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.469 -0.77 . . . . 0.0 110.079 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -60.01 2.63 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.275 -0.89 . . . . 0.0 110.115 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.569 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -44.7 -48.65 10.69 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.881 0.848 . . . . 0.0 109.832 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.429 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -60.04 -40.59 89.92 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.357 0.598 . . . . 0.0 109.819 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -62.52 -33.58 75.18 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.459 -0.775 . . . . 0.0 110.474 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -100.26 -4.26 29.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.271 178.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.203 179.755 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.567 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.287 1 C3'-C2'-C1' 114.643 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.567 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.675 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.918 1 C3'-C2'-C1' 115.032 8.809 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.577 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.087 1 C3'-C2'-C1' 115.1 8.857 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.735 2 C3'-C2'-C1' 114.636 8.525 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.532 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.954 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.581 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.824 2 C3'-C2'-C1' 114.049 8.106 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.581 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.474 " H4'" ' HB2' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.624 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.409 -10.94 1 C3'-C2'-C1' 115.251 8.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.624 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.672 8.551 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.88 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.414 -10.392 1 C3'-C2'-C1' 114.819 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.612 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.57 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.718 2 C3'-C2'-C1' 114.613 8.509 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.584 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.254 2 C3'-C2'-C1' 115.683 9.274 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.584 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.937 8.741 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.516 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.822 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.516 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.198 2 C3'-C2'-C1' 114.768 8.62 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.51 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.344 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.63 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.452 2 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.63 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.202 1 C3'-C2'-C1' 114.628 8.52 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.881 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.413 -10.487 1 C3'-C2'-C1' 114.889 8.707 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.437 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.09 1 C3'-C2'-C1' 114.993 8.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.61 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.835 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.61 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.413 -10.499 2 C3'-C2'-C1' 115.013 8.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.433 ' H6 ' " H2'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.913 2 C3'-C2'-C1' 114.676 8.554 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.464 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.377 1 C3'-C2'-C1' 114.856 8.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.67 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 1 C3'-C2'-C1' 114.811 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.67 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.409 -10.851 2 C3'-C2'-C1' 114.861 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.611 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.211 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.681 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.403 -11.465 1 C3'-C2'-C1' 114.512 8.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.908 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.414 -10.408 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.79 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.624 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.516 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.741 8.601 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.409 -10.922 2 C3'-C2'-C1' 114.585 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.431 2 C3'-C2'-C1' 114.299 8.285 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.234 0.54 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HB3' HG23 ' A' ' 8' ' ' THR . 31.6 mmtp -98.44 115.68 29.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.328 -0.857 . . . . 0.0 109.926 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -141.29 82.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.297 -0.877 . . . . 0.0 110.631 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.471 ' HB1' HD12 ' A' ' 7' ' ' LEU . . . -125.23 -154.94 0.65 Allowed 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.223 -0.923 . . . . 0.0 110.09 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.559 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -134.2 87.0 2.32 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.327 -0.858 . . . . 0.0 109.423 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.9 OUTLIER 79.63 24.93 0.42 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.451 0.643 . . . . 0.0 109.468 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.471 HD12 ' HB1' ' A' ' 4' ' ' ALA . 30.7 mt -119.71 -24.29 6.24 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.63 -0.669 . . . . 0.0 110.026 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.561 HG23 ' HB3' ' A' ' 2' ' ' LYS . 21.1 m -79.78 64.57 4.68 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.5 p-10 -39.79 -33.52 0.2 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.817 -0.552 . . . . 0.0 110.167 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -57.58 -49.63 75.76 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.441 -0.787 . . . . 0.0 109.31 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -80.86 -28.47 36.04 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 117.652 -1.619 . . . . 0.0 109.012 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.927 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.6 OUTLIER -52.69 -43.41 65.57 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 176.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.062 ' NE1' HD11 ' A' ' 17' ' ' LEU . 19.9 t-105 -61.89 -40.52 95.72 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.49 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.3 tp-100 -62.76 -30.69 71.64 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -72.43 -29.3 63.58 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.236 1.017 . . . . 0.0 108.47 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.928 HG12 ' HE1' ' A' ' 46' ' ' HIS . 39.0 t -74.98 -35.89 36.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 122.355 1.074 . . . . 0.0 111.883 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.062 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.261 4.3 mt -86.58 -32.69 20.51 Favored 'General case' 0 C--N 1.263 -3.171 0 CA-C-O 122.321 1.058 . . . . 0.0 108.845 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 19' ' ' ARG . . . -76.31 -19.23 58.45 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.939 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 11.3 ttm180 75.14 37.87 0.45 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.41 -0.806 . . . . 0.0 109.223 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -70.01 110.07 5.96 Favored Pre-proline 0 C--N 1.303 -1.452 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.899 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.3 Cg_endo -72.72 6.33 2.45 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.813 1.428 . . . . 0.0 109.896 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.306 1.4 t30 -103.0 -11.61 18.05 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.11 0.957 . . . . 0.0 109.103 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -110.14 -6.1 15.18 Favored 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.868 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.266 29.8 t0 -76.32 124.19 27.13 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.734 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.84 -32.08 7.85 Favored Glycine 0 N--CA 1.506 3.343 0 N-CA-C 106.89 -2.484 . . . . 0.0 106.89 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.5 OUTLIER -77.1 -46.5 23.37 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 121.798 -0.825 . . . . 0.0 109.254 178.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.8 p90 -144.88 170.6 15.83 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 122.261 1.029 . . . . 0.0 110.794 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -127.56 175.51 9.24 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.129 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.796 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.75 119.86 14.56 Favored 'General case' 0 C--N 1.282 -2.364 0 C-N-CA 118.093 -1.443 . . . . 0.0 108.832 176.249 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -98.25 113.29 25.18 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.133 -175.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.934 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.19 112.84 24.28 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.269 46.3 mtt85 -70.19 -20.11 63.13 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.026 0.917 . . . . 0.0 111.193 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.934 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.59 -32.87 74.49 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 121.522 0.677 . . . . 0.0 109.357 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.627 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.8 t -116.34 3.62 13.35 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.559 -0.857 . . . . 0.0 110.771 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.2 34.73 81.23 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.87 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 51.3 mt -125.22 164.71 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -1.103 . . . . 0.0 109.367 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 5.2 p90 -145.7 116.59 7.76 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.469 ' SG ' ' HB2' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.674 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.252 6.6 mtp180 -89.21 178.18 2.14 Favored Pre-proline 0 C--N 1.279 -2.48 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.001 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.774 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 41.1 Cg_endo -69.35 -16.89 39.57 Favored 'Trans proline' 0 C--N 1.29 -2.537 0 O-C-N 123.355 1.187 . . . . 0.0 111.273 -179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 51.9 p -115.36 30.77 7.13 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.674 -1.267 . . . . 0.0 113.788 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 45.1 t -50.73 137.41 20.21 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.451 -1.406 . . . . 0.0 109.458 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.436 ' NH2' ' N3 ' ' B' ' 197' ' ' ' DA' . 1.1 ptm180 -100.89 5.08 43.21 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.387 -178.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.622 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.06 -51.08 5.64 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.372 -1.455 . . . . 0.0 112.535 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 17.2 ttm180 174.02 -179.09 0.1 Allowed 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.928 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.4 m-70 -139.65 160.05 40.77 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.345 -1.472 . . . . 0.0 114.728 -178.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.772 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -118.63 160.53 21.65 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.695 177.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.8 mt -53.22 159.94 1.2 Allowed 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.186 -0.946 . . . . 0.0 112.379 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.621 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 32.7 ttp180 -69.09 -30.38 68.67 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 122.996 1.379 . . . . 0.0 108.709 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.281 0.7 OUTLIER -39.36 -62.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.935 0 CA-C-N 114.09 -1.414 . . . . 0.0 112.052 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.2 m-80 -89.75 17.05 6.98 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.653 0.739 . . . . 0.0 109.042 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -111.97 121.74 64.99 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 O-C-N 121.547 -0.721 . . . . 0.0 111.214 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.796 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.38 175.16 5.95 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 72.3 m-85 -119.59 150.15 40.77 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.354 1.073 . . . . 0.0 111.96 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.7 m-85 -130.83 154.88 47.57 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.568 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -71.2 -39.89 71.51 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.492 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.96 164.1 29.86 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.434 1.112 . . . . 0.0 110.495 178.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.708 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.44 -22.19 66.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.226 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.665 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -73.03 -35.83 66.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.532 -1.355 . . . . 0.0 108.625 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 15.5 tp10 -62.26 -48.99 77.48 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.8 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.11 -45.37 87.39 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.9 mt -60.41 -27.95 67.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.5 -18.03 55.39 Favored 'General case' 0 C--N 1.31 -1.113 0 O-C-N 121.66 -0.65 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.7 0.39 23.65 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 122.028 0.918 . . . . 0.0 110.49 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.78 35.29 13.49 Favored Glycine 0 C--N 1.284 -2.318 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 19.8 m-85 -111.15 160.99 16.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.347 -1.09 . . . . 0.0 111.149 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.85 121.56 53.83 Favored Pre-proline 0 C--N 1.3 -1.577 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 178.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.73 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.5 Cg_endo -63.63 134.72 45.53 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.588 1.309 . . . . 0.0 110.908 -178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.851 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 5.8 t -59.7 121.95 12.92 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.258 0.552 . . . . 0.0 110.098 -178.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.618 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.0 OUTLIER -64.9 9.0 0.1 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.525 -0.735 . . . . 0.0 111.065 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.269 0.0 OUTLIER -113.08 -33.44 6.02 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -179.908 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 52.1 m -100.61 -19.34 16.16 Favored 'General case' 0 N--CA 1.5 2.032 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.967 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 63.1 tp60 -81.52 -43.78 1.11 Allowed Pre-proline 0 C--N 1.3 -1.555 0 O-C-N 121.252 -0.905 . . . . 0.0 111.244 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 46.9 Cg_endo -77.12 -34.32 2.24 Favored 'Trans proline' 0 C--N 1.315 -1.209 0 O-C-N 122.957 0.977 . . . . 0.0 110.907 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.674 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 4.5 p-10 -74.97 178.42 5.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.116 -0.99 . . . . 0.0 109.837 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 21.2 mttt -113.74 131.19 56.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.068 -1.02 . . . . 0.0 111.675 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.747 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -87.09 -112.14 0.05 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.023 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.1 m120 -61.68 -30.02 5.89 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 119.766 -1.834 . . . . 0.0 107.888 175.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.023 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.6 Cg_endo -60.36 -16.9 44.07 Favored 'Trans proline' 0 N--CA 1.487 1.102 0 N-CA-C 107.108 -1.92 . . . . 0.0 107.108 175.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -51.24 -64.64 0.75 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -49.36 -34.49 16.15 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.714 -0.616 . . . . 0.0 111.729 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 25.3 m170 -68.99 -42.92 75.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.057 -1.027 . . . . 0.0 109.301 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.429 ' HB2' ' HD3' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -67.85 -22.67 65.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.992 -1.068 . . . . 0.0 108.888 178.025 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 124' ' ' THR . 4.0 tp -77.58 -33.17 54.03 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 0.7 OUTLIER -61.59 -37.5 84.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 176.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -58.52 -50.18 74.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.69 -0.631 . . . . 0.0 110.492 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.752 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -61.83 -35.61 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.482 0 O-C-N 120.526 -1.359 . . . . 0.0 110.577 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.965 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.0 m -55.08 -40.54 70.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 119.987 -1.695 . . . . 0.0 107.217 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -57.53 -40.04 77.91 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.998 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.95 -31.38 60.45 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.965 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.81 -58.14 9.12 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 96' ' ' GLN . 3.1 ttt180 -49.16 -54.29 17.03 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.323 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.8 HD23 ' OG1' ' A' ' 101' ' ' THR . 7.9 mp -56.41 -36.7 69.23 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.596 -0.69 . . . . 0.0 112.557 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.998 HD12 ' O ' ' A' ' 90' ' ' ALA . 1.6 mt -69.38 -11.05 60.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.816 -0.552 . . . . 0.0 110.84 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.454 ' CG ' ' OXT' ' A' ' 139' ' ' ARG . 4.7 tm-20 -129.69 -5.93 4.62 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.682 -0.807 . . . . 0.0 109.067 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.1 tp60 -90.25 -65.02 1.05 Allowed 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.446 -0.784 . . . . 0.0 110.13 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -88.25 -156.52 0.37 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 118.562 -1.255 . . . . 0.0 111.245 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.663 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.0 m -106.11 -74.41 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.663 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 39.9 Cg_endo -66.34 119.33 6.34 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 N-CA-C 105.065 -2.706 . . . . 0.0 105.065 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.792 ' CG1' HD12 ' A' ' 102' ' ' LEU . 98.6 t -78.26 170.48 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.347 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.8 ' OG1' HD23 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.46 97.36 7.04 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 116.517 -2.073 . . . . 0.0 106.39 178.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.926 ' CD2' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -131.62 -37.41 1.2 Allowed 'General case' 0 C--N 1.272 -2.769 0 CA-C-N 112.006 -2.361 . . . . 0.0 105.648 178.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 9.1 tp10 -40.2 -45.46 2.05 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 122.0 -0.438 . . . . 0.0 111.913 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.09 -39.83 78.77 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.693 -1.254 . . . . 0.0 110.039 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -72.33 -46.3 56.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.988 . . . . 0.0 110.338 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -60.72 -44.69 96.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.383 -0.823 . . . . 0.0 110.482 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.1 m-20 -64.69 -40.47 95.43 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.331 -0.855 . . . . 0.0 110.776 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -42.96 92.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.177 -0.952 . . . . 0.0 111.23 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.761 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 25.2 t -87.01 -16.89 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.099 -1.001 . . . . 0.0 110.885 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.7 30.08 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.572 -0.705 . . . . 0.0 110.149 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.596 ' HG2' ' HB ' ' A' ' 109' ' ' VAL . 8.7 ptp -131.49 155.95 46.51 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.462 -0.774 . . . . 0.0 111.052 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.411 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.13 170.76 12.49 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.622 -0.674 . . . . 0.0 111.315 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.543 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 37.3 Cg_endo -62.08 -28.78 80.47 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.802 1.422 . . . . 0.0 109.786 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -69.04 -38.02 78.92 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 118.163 -1.415 . . . . 0.0 108.559 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.864 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 4.2 t60 -71.05 -28.89 64.7 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 116.69 -2.004 . . . . 0.0 110.42 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 102' ' ' LEU . 0.5 OUTLIER -61.78 -43.21 99.3 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 113' ' ' PRO . 11.9 m170 -58.46 -40.02 81.51 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.607 ' HA ' ' HB3' ' A' ' 128' ' ' PRO . 3.3 tpp180 -59.26 -36.79 76.13 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.148 -0.97 . . . . 0.0 109.385 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.63 ' O ' HD23 ' A' ' 119' ' ' LEU . 3.5 tt -67.51 -44.79 77.57 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.219 -0.925 . . . . 0.0 108.566 177.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.695 ' CE2' HG22 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -49.54 -40.05 36.8 Favored 'General case' 0 N--CA 1.513 2.691 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.895 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 3.5 tttp -72.75 -41.03 65.57 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.157 -0.964 . . . . 0.0 109.779 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.56 -54.12 50.47 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.294 -0.879 . . . . 0.0 108.926 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 84' ' ' LEU . 8.7 m -69.05 -60.49 2.32 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.952 ' HA ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -52.32 -32.77 39.52 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.693 -1.255 . . . . 0.0 108.259 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.77 -38.76 3.15 Favored Glycine 0 N--CA 1.494 2.538 0 CA-C-O 118.128 -1.374 . . . . 0.0 114.647 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.57 ' O ' ' OG1' ' A' ' 127' ' ' THR . 17.4 mtp -158.86 49.18 0.35 Allowed 'General case' 0 N--CA 1.513 2.686 0 CA-C-N 122.848 3.324 . . . . 0.0 115.293 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.026 HG21 ' CE3' ' A' ' 131' ' ' TRP . 87.0 m -170.72 82.02 0.55 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 120.507 -1.371 . . . . 0.0 110.094 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.895 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 50.5 Cg_endo -72.82 -102.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 122.572 0.774 . . . . 0.0 113.025 -178.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 1.126 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 2.2 tptm -60.03 -21.94 62.02 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.266 -0.896 . . . . 0.0 111.112 -178.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.599 ' HA ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -69.05 -34.67 75.56 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.864 -1.147 . . . . 0.0 108.588 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.026 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.17 -41.68 97.02 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 177.01 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG3' HD22 ' A' ' 94' ' ' LEU . 6.1 tm0? -58.22 -33.19 69.05 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.574 177.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -68.81 -56.48 7.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.437 -0.789 . . . . 0.0 109.346 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.544 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -52.79 -42.16 64.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.256 -0.903 . . . . 0.0 109.205 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.78 ' CD1' ' HB2' ' A' ' 91' ' ' CYS 0.291 0.0 OUTLIER -51.53 -52.94 42.81 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.3 1.048 . . . . 0.0 109.372 177.009 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.414 ' HA ' ' HG3' ' A' ' 95' ' ' GLU . 5.1 ttm180 -62.81 -20.13 64.74 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.955 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -80.38 -40.29 26.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.482 -0.761 . . . . 0.0 111.161 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -100.21 -35.3 9.69 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.988 -1.07 . . . . 0.0 109.898 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.454 ' OXT' ' CG ' ' A' ' 95' ' ' GLU . 1.1 ttt180 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.493 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.556 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.329 1 C3'-C2'-C1' 114.729 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.556 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.652 3 C3'-C2'-C1' 113.667 7.834 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.454 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.13 1 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.544 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 115.015 8.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.556 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.817 2 C3'-C2'-C1' 114.57 8.478 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.564 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.047 2 C3'-C2'-C1' 114.236 8.24 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.603 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.803 2 C3'-C2'-C1' 114.195 8.211 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.603 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.452 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.152 2 C3'-C2'-C1' 114.737 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.608 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.812 1 C3'-C2'-C1' 115.291 8.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.608 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.353 2 C3'-C2'-C1' 114.654 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.864 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.408 -11.024 1 C3'-C2'-C1' 114.632 8.523 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.659 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.75 1 C3'-C2'-C1' 114.55 8.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.586 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.646 2 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.497 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.171 2 C3'-C2'-C1' 115.653 9.252 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.497 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.678 2 C3'-C2'-C1' 114.921 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.514 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.822 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.514 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.27 2 C3'-C2'-C1' 114.74 8.6 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.558 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -10.968 2 C3'-C2'-C1' 114.501 8.429 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.558 " O5'" H2'' ' C' ' 221' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.959 1 C3'-C2'-C1' 114.595 8.496 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.507 ' P ' ' NZ ' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.417 -10.065 2 C3'-C2'-C1' 114.777 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 1.126 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.246 1 C3'-C2'-C1' 114.994 8.781 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.463 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.419 -9.942 1 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.463 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.927 1 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.5 ' C6 ' ' N1 ' ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.234 2 C3'-C2'-C1' 115.283 8.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.498 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.64 2 C3'-C2'-C1' 114.644 8.532 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.515 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.398 1 C3'-C2'-C1' 114.793 8.638 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.649 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.057 2 C3'-C2'-C1' 114.795 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 ' H71' " H2'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.666 H2'' " O5'" ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.386 2 C3'-C2'-C1' 114.967 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.851 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.176 2 C3'-C2'-C1' 114.404 8.36 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.87 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.844 1 C3'-C2'-C1' 114.76 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.743 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.724 2 C3'-C2'-C1' 115.599 9.214 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.515 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.239 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.407 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.705 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.489 2 C3'-C2'-C1' 114.36 8.329 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 tpt . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.093 0.473 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -169.78 -38.2 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.298 -0.876 . . . . 0.0 110.716 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -100.5 149.91 23.21 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.665 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . -92.21 -154.67 0.39 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.366 -0.834 . . . . 0.0 108.786 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.56 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -69.81 41.47 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.088 -1.008 . . . . 0.0 110.72 179.849 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.56 ' HB2' ' O ' ' A' ' 5' ' ' THR . 34.1 m 79.49 50.43 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.77 -0.581 . . . . 0.0 110.072 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -172.12 39.79 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 O-C-N 121.366 -0.834 . . . . 0.0 111.536 -179.403 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.737 HG22 ' H ' ' A' ' 11' ' ' GLN . 20.6 m -79.75 64.07 4.5 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.209 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.7 p30 -43.94 -31.35 0.87 Allowed 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.475 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -60.18 -49.92 75.73 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 121.6 -0.688 . . . . 0.0 109.413 178.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.737 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.07 -27.01 43.01 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 117.309 -1.756 . . . . 0.0 108.951 178.463 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.888 ' O ' HG23 ' A' ' 16' ' ' VAL . 76.2 mmt-85 -53.92 -42.57 68.92 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 105.133 -2.173 . . . . 0.0 105.133 176.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 26.7 t-105 -62.36 -40.71 97.3 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 7.7 tt0 -62.59 -30.05 71.04 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLN . 1.4 m -74.04 -31.36 62.85 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 12' ' ' ARG . 59.7 t -74.59 -34.61 35.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 122.199 0.999 . . . . 0.0 111.634 -179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.1 mt -89.26 -31.42 17.88 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.16 0.981 . . . . 0.0 109.365 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -80.03 -15.7 56.65 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.29 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.709 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 1.9 mtt-85 67.16 41.82 2.48 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.304 -0.872 . . . . 0.0 109.581 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.2 t0 -70.1 109.54 5.02 Favored Pre-proline 0 C--N 1.298 -1.632 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.521 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.5 Cg_endo -69.62 6.18 1.36 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.715 1.376 . . . . 0.0 109.84 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.448 ' C ' HD21 ' A' ' 78' ' ' ASN 0.305 1.2 t30 -104.3 -11.18 17.32 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.987 0.898 . . . . 0.0 109.026 -178.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.762 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.11 -5.98 15.23 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 122.282 1.039 . . . . 0.0 108.64 177.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.5 t0 -76.97 129.08 35.65 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.846 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.98 -33.89 6.07 Favored Glycine 0 N--CA 1.509 3.544 0 N-CA-C 106.177 -2.769 . . . . 0.0 106.177 -176.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 27.1 tt0 -75.86 -45.66 34.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.762 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 14.3 p90 -150.62 170.44 19.16 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 122.541 1.163 . . . . 0.0 111.819 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -126.9 175.8 8.23 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.806 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.6 OUTLIER -138.3 119.81 14.96 Favored 'General case' 0 C--N 1.281 -2.4 0 C-N-CA 118.234 -1.386 . . . . 0.0 108.688 176.077 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.55 112.85 24.54 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.75 -175.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.018 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.4 101.94 11.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 49.2 mtp180 -63.58 -20.03 65.31 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 122.004 0.907 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.018 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.98 -32.51 74.03 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.699 0.761 . . . . 0.0 109.114 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.628 HG22 ' HB ' ' A' ' 31' ' ' VAL . 7.6 t -117.2 5.19 12.67 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.494 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.4 33.62 76.95 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.895 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 57.1 mt -124.0 164.21 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.251 -1.147 . . . . 0.0 109.118 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.756 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 2.8 p90 -146.95 117.84 7.65 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 175.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.519 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.653 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 5.8 mtp180 -95.54 178.11 1.56 Allowed Pre-proline 0 C--N 1.277 -2.586 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.818 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 39.2 Cg_endo -67.54 -14.4 42.13 Favored 'Trans proline' 0 C--N 1.289 -2.601 0 O-C-N 123.102 1.054 . . . . 0.0 111.574 -178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 40.2 p -115.36 30.72 7.17 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.578 -1.326 . . . . 0.0 113.798 -178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 48.0 t -55.78 136.61 50.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.425 -1.422 . . . . 0.0 109.618 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.523 ' CB ' " H5'" ' B' ' 199' ' ' ' DA' . 0.0 OUTLIER -101.04 1.27 39.31 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.674 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -83.36 -51.02 7.77 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.39 -1.444 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.87 178.53 0.14 Allowed 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.7 m-70 -140.15 159.05 43.05 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.281 -1.512 . . . . 0.0 113.902 -178.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.648 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.15 157.76 28.35 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.136 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -50.65 155.62 1.08 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.242 -0.911 . . . . 0.0 112.163 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.607 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.281 0.0 OUTLIER -62.64 -30.17 71.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.875 1.321 . . . . 0.0 108.571 178.72 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.15 -62.36 0.75 Allowed 'General case' 0 C--N 1.294 -1.838 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.044 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 75.1 m-20 -90.52 17.12 7.79 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -115.37 122.06 68.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.912 0 O-C-N 121.746 -0.597 . . . . 0.0 110.842 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.806 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.13 175.25 5.87 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.5 m-85 -119.45 150.22 40.57 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.232 1.015 . . . . 0.0 111.693 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 41.7 m-85 -130.4 154.94 47.19 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.489 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.87 -39.88 76.07 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.5 p30 -139.77 165.37 27.47 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 122.478 1.132 . . . . 0.0 110.707 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.694 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.74 -23.87 67.54 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.234 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.624 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -70.88 -37.09 73.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.695 -1.253 . . . . 0.0 108.94 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 6.6 tp10 -61.93 -48.47 80.29 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.756 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.67 -44.18 93.7 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.716 HD21 ' HG3' ' A' ' 68' ' ' PRO . 61.8 mt -61.26 -28.37 69.13 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.1 -16.97 53.83 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.618 -0.676 . . . . 0.0 110.154 179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.04 0.37 24.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.237 -0.914 . . . . 0.0 110.455 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.23 37.57 10.98 Favored Glycine 0 C--N 1.286 -2.235 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 17.6 m-85 -112.89 160.16 18.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -1.126 . . . . 0.0 111.291 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -99.86 117.08 64.09 Favored Pre-proline 0 C--N 1.301 -1.518 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.716 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.6 Cg_endo -61.74 139.13 78.91 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.579 1.305 . . . . 0.0 111.091 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.639 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -62.77 128.07 34.19 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.379 0.609 . . . . 0.0 110.36 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.6 ' O ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.74 5.39 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.718 -0.614 . . . . 0.0 111.342 -179.209 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.251 0.0 OUTLIER -117.32 -35.1 4.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.003 -1.06 . . . . 0.0 109.276 -179.67 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.8 m -94.79 -13.58 25.48 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.682 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 37.7 tp60 -87.9 -44.19 0.49 Allowed Pre-proline 0 C--N 1.301 -1.533 0 O-C-N 121.311 -0.868 . . . . 0.0 111.482 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 51.2 Cg_endo -80.35 -25.41 4.75 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 122.943 0.97 . . . . 0.0 111.394 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 26.7 p-10 -78.65 178.33 7.92 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.116 -0.99 . . . . 0.0 110.717 -179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 8.6 mmtt -110.08 140.07 44.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.833 . . . . 0.0 110.798 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.846 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -99.18 -115.11 0.16 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.466 -0.771 . . . . 0.0 110.089 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.045 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.3 m120 -62.14 -30.61 6.39 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 119.444 -2.035 . . . . 0.0 108.064 176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.045 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.5 Cg_endo -62.31 -20.0 68.82 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 106.984 -1.968 . . . . 0.0 106.984 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 8.4 ttm105 -54.59 -65.71 0.53 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 121.434 0.635 . . . . 0.0 109.403 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -50.47 -34.67 25.76 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.09 -1.006 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -69.02 -41.87 77.16 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.087 -1.008 . . . . 0.0 109.122 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 87' ' ' ILE . 10.7 ttt85 -67.66 -21.26 65.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.011 . . . . 0.0 108.491 177.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.987 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.52 -34.61 53.98 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 178.7 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.0 -37.69 80.41 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 107.95 -1.129 . . . . 0.0 107.95 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 tttt -59.61 -50.29 74.44 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.74 -0.6 . . . . 0.0 110.43 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.784 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -58.89 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.851 -1.156 . . . . 0.0 110.513 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 69.6 m -53.24 -46.35 69.13 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.256 -1.528 . . . . 0.0 107.408 176.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -55.09 -38.02 67.57 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.813 -1.181 . . . . 0.0 107.813 176.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.896 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.72 -38.06 66.64 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 13.9 t -62.17 -49.5 75.55 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 117.984 -1.486 . . . . 0.0 108.253 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 96' ' ' GLN . 0.0 OUTLIER -47.99 -54.08 14.05 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.82 . . . . 0.0 109.845 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.465 HD23 ' CB ' ' A' ' 101' ' ' THR . 1.1 mp -56.12 -36.72 68.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.605 -0.685 . . . . 0.0 111.263 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.896 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.02 -10.38 57.23 Favored 'General case' 0 N--CA 1.505 2.296 0 CA-C-O 121.4 0.619 . . . . 0.0 110.195 -178.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.496 ' HB2' ' CD ' ' A' ' 136' ' ' ARG . 26.8 tp10 -129.98 -10.16 4.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.469 -0.769 . . . . 0.0 110.064 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -90.17 -54.59 3.96 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.306 -0.871 . . . . 0.0 110.772 -179.242 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 93' ' ' LEU . 6.5 pt-20 -87.55 -155.91 0.32 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.648 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.535 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.1 m -105.35 -63.89 0.04 OUTLIER Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.852 . . . . 0.0 109.628 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.535 ' CD ' ' HB ' ' A' ' 98' ' ' THR . 38.2 Cg_endo -65.62 140.44 62.43 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 N-CA-C 108.644 -1.329 . . . . 0.0 108.644 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.639 HG13 ' HG ' ' A' ' 94' ' ' LEU . 11.6 t -78.21 150.45 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 120.685 -1.259 . . . . 0.0 109.627 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.536 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -119.12 98.17 6.04 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 123.081 1.419 . . . . 0.0 112.562 -179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 101' ' ' THR . 1.6 mp -132.03 -21.7 2.37 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 176.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 8.7 tp10 -39.08 -45.31 1.25 Allowed 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.66 -40.25 76.56 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 117.894 -1.522 . . . . 0.0 109.161 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 1.008 HD23 HD11 ' A' ' 116' ' ' LEU . 1.2 tp -69.54 -56.31 7.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.622 -0.674 . . . . 0.0 110.011 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -51.38 -42.42 61.35 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 110.514 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 25.7 m-20 -65.46 -39.96 92.61 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.321 -0.862 . . . . 0.0 110.271 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -64.2 -41.46 97.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.399 -0.813 . . . . 0.0 111.194 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.766 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.5 t -90.46 -19.54 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.127 -0.983 . . . . 0.0 110.655 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.72 41.67 0.07 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.681 -0.637 . . . . 0.0 111.128 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 6.1 ptt? -140.11 171.64 13.89 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.976 -1.078 . . . . 0.0 111.717 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.83 170.71 12.39 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.728 -0.608 . . . . 0.0 111.361 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 102' ' ' LEU . 37.8 Cg_endo -63.25 -32.05 73.7 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 O-C-N 123.736 1.388 . . . . 0.0 110.306 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.563 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 7.9 m-30 -69.42 -44.81 70.6 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.47 -1.292 . . . . 0.0 109.093 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.724 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 5.8 t-80 -70.57 -22.73 62.55 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 116.959 -1.897 . . . . 0.0 110.629 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.008 HD11 HD23 ' A' ' 105' ' ' LEU . 2.9 tm? -65.66 -42.71 91.05 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 77.2 m-70 -62.3 -39.72 93.92 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.483 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.1 OUTLIER -58.95 -36.5 74.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.203 -0.936 . . . . 0.0 109.431 176.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.9 tm? -67.42 -44.29 79.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.954 -1.091 . . . . 0.0 108.491 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.645 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.277 0.5 OUTLIER -49.17 -40.0 31.3 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 177.845 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.943 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -75.33 -40.06 58.75 Favored 'General case' 0 N--CA 1.515 2.811 0 O-C-N 120.843 -1.161 . . . . 0.0 110.211 176.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.96 -54.16 50.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.495 -0.753 . . . . 0.0 109.276 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.987 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -69.34 -60.17 2.51 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.848 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.821 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.46 -32.75 18.81 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.715 -1.241 . . . . 0.0 107.861 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.47 -40.33 2.59 Favored Glycine 0 N--CA 1.493 2.482 0 CA-C-O 118.158 -1.357 . . . . 0.0 114.481 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.643 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 2.6 mmt -157.65 48.67 0.41 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-N 122.684 3.242 . . . . 0.0 115.032 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.075 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.04 84.16 0.51 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 120.457 -1.402 . . . . 0.0 110.028 176.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.943 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.3 Cg_endo -72.34 -112.16 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 122.516 0.745 . . . . 0.0 113.244 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.876 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 31.9 tttt -55.66 -25.88 41.68 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.281 -0.887 . . . . 0.0 111.134 -178.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.27 75.58 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.239 -0.913 . . . . 0.0 109.223 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.075 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.09 -38.98 93.04 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.468 -1.395 . . . . 0.0 107.859 176.322 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.627 ' HG3' HD22 ' A' ' 94' ' ' LEU . 1.1 tm0? -67.19 -42.48 84.1 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.525 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -63.39 -48.72 76.69 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.088 -1.008 . . . . 0.0 110.842 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -58.76 6.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.289 -0.882 . . . . 0.0 110.761 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.704 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.1 OUTLIER -46.6 -47.59 19.91 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.379 -0.826 . . . . 0.0 109.907 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.496 ' CD ' ' HB2' ' A' ' 95' ' ' GLU . 5.9 ttp180 -59.41 -37.08 77.11 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.491 0.662 . . . . 0.0 109.969 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.19 70.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.507 -0.745 . . . . 0.0 110.245 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -100.26 -10.23 21.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.296 -0.877 . . . . 0.0 109.176 178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.164 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.505 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.403 -11.486 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.534 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.665 3 C3'-C2'-C1' 113.611 7.794 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.534 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.305 1 C3'-C2'-C1' 115.233 8.952 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.566 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.012 1 C3'-C2'-C1' 114.883 8.702 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.566 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.052 2 C3'-C2'-C1' 114.59 8.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.523 " H2'" ' H71' ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -10.02 2 C3'-C2'-C1' 114.209 8.221 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.599 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.407 -11.112 1 C3'-C2'-C1' 114.291 8.279 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.599 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.003 2 C3'-C2'-C1' 114.829 8.663 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.437 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.998 2 C3'-C2'-C1' 114.681 8.558 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.554 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.651 1 C3'-C2'-C1' 115.123 8.874 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.554 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.973 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.724 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.413 -10.531 1 C3'-C2'-C1' 114.661 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.664 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.408 -10.975 1 C3'-C2'-C1' 114.592 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.591 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.57 2 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.535 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.241 2 C3'-C2'-C1' 115.705 9.29 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.535 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.689 2 C3'-C2'-C1' 114.951 8.751 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.526 ' C6 ' ' N6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.869 8.692 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.526 ' N6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.331 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.472 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.406 -11.157 2 C3'-C2'-C1' 114.381 8.344 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.563 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 114.557 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.563 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.416 -10.159 2 C3'-C2'-C1' 114.838 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.876 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.312 1 C3'-C2'-C1' 114.854 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.478 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.002 1 C3'-C2'-C1' 115.016 8.797 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.58 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.847 2 C3'-C2'-C1' 114.467 8.405 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.58 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.094 1 C3'-C2'-C1' 115.106 8.861 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.47 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.725 2 C3'-C2'-C1' 114.666 8.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.513 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.445 1 C3'-C2'-C1' 114.783 8.631 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.513 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.031 1 C3'-C2'-C1' 114.656 8.54 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.704 2 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.225 2 C3'-C2'-C1' 114.92 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.674 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.408 -11.01 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.895 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.41 -10.816 2 C3'-C2'-C1' 114.966 8.762 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.824 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.573 1 C3'-C2'-C1' 115.615 9.225 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.162 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.418 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.781 2 C3'-C2'-C1' 114.693 8.567 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.379 2 C3'-C2'-C1' 114.298 8.284 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.12 0.486 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' HG21 ' A' ' 8' ' ' THR . 0.4 OUTLIER 51.88 35.61 16.11 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.396 -0.815 . . . . 0.0 110.195 -179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.439 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 13.5 mtmt -54.06 132.94 43.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.418 -0.802 . . . . 0.0 110.474 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.57 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -111.21 -154.66 0.55 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 121.268 -0.895 . . . . 0.0 108.811 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.594 ' O ' HG23 ' A' ' 5' ' ' THR . 11.9 t -66.35 49.2 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.288 -0.882 . . . . 0.0 109.868 179.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.668 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 1.8 t 79.55 101.44 0.06 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.669 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 4.4 mt 94.57 80.28 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 122.108 0.956 . . . . 0.0 111.527 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.507 HG21 ' O ' ' A' ' 2' ' ' LYS . 28.2 m -79.92 64.64 4.82 Favored 'General case' 0 C--N 1.291 -1.935 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 177.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.18 -29.43 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 120.984 0.421 . . . . 0.0 110.671 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' THR . 28.2 m-20 -57.82 -51.35 69.95 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.098 -1.001 . . . . 0.0 109.197 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.536 ' HG3' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.93 -27.09 43.68 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 117.33 -1.748 . . . . 0.0 108.693 178.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.894 ' O ' HG23 ' A' ' 16' ' ' VAL . 31.5 mmt180 -52.73 -45.98 67.21 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 176.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 25.7 t-105 -57.77 -40.42 79.74 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 1.5 tm0? -63.84 -29.84 70.99 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 118.755 -1.178 . . . . 0.0 107.89 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -74.75 -31.23 61.73 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 122.39 1.09 . . . . 0.0 108.501 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.047 ' HA ' ' O ' ' A' ' 40' ' ' PRO . 55.1 t -69.57 -45.21 78.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 CA-C-O 122.407 1.098 . . . . 0.0 111.236 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.272 5.2 mt -77.39 -31.4 54.19 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-O 122.21 1.005 . . . . 0.0 109.57 179.736 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ARG . . . -80.29 -13.0 59.55 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.961 -177.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.698 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.5 tpp180 67.25 41.57 2.48 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.66 -1.275 . . . . 0.0 107.67 -178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -70.21 110.27 6.46 Favored Pre-proline 0 N--CA 1.486 1.37 0 O-C-N 121.513 -0.742 . . . . 0.0 110.036 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 48.5 Cg_endo -72.91 5.86 2.77 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 O-C-N 123.732 1.385 . . . . 0.0 110.342 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 1.2 t30 -105.94 -11.37 16.21 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.04 -5.91 15.28 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.074 0.94 . . . . 0.0 108.87 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.81 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 29.7 t0 -72.42 127.25 31.99 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.779 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.52 -30.76 9.55 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 106.571 -2.612 . . . . 0.0 106.571 -176.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -76.79 -47.16 22.39 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.893 -0.769 . . . . 0.0 109.135 178.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 21.2 p90 -152.57 170.42 20.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 122.442 1.115 . . . . 0.0 112.526 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.2 m -125.49 176.11 6.73 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.832 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.7 OUTLIER -139.7 121.82 15.78 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 118.294 -1.362 . . . . 0.0 109.23 176.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.02 112.74 24.78 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.045 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.013 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -86.96 102.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 177.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.274 6.7 mtp180 -63.52 -20.0 65.24 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.921 0.867 . . . . 0.0 111.354 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.013 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.22 -32.26 73.58 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-O 121.675 0.75 . . . . 0.0 109.106 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.55 HG22 ' HB ' ' A' ' 31' ' ' VAL . 6.8 t -117.31 5.66 12.63 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.608 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 58.9 34.62 79.15 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.616 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 61.7 mt -124.08 161.29 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.284 -1.127 . . . . 0.0 109.348 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.764 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 1.8 p90 -144.75 123.67 12.73 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.642 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.914 ' HD2' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -72.34 178.42 1.38 Allowed Pre-proline 0 C--N 1.277 -2.577 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 176.031 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 1.047 ' O ' ' HA ' ' A' ' 16' ' ' VAL . 44.0 Cg_endo -79.22 -1.71 11.77 Favored 'Trans proline' 0 C--N 1.275 -3.315 0 O-C-N 123.022 1.012 . . . . 0.0 109.589 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.698 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 1.5 p -116.38 21.26 13.69 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.482 -1.387 . . . . 0.0 112.718 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 36.9 t -59.66 119.79 8.27 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 119.596 -1.94 . . . . 0.0 109.864 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.812 ' HD2' ' H ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -101.3 9.16 41.99 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.029 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -60.45 -50.37 73.87 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 118.598 -1.241 . . . . 0.0 109.484 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.934 ' HB3' " H4'" ' C' ' 234' ' ' ' DT' . 4.8 ttp180 170.91 177.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 103.44 -2.8 . . . . 0.0 103.44 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 1.177 ' O ' ' OP1' ' C' ' 235' ' ' ' DT' . 5.7 m-70 -141.11 151.73 44.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 119.075 -2.266 . . . . 0.0 116.195 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.423 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -104.15 158.52 16.38 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.639 176.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.03 159.09 0.94 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.087 -1.008 . . . . 0.0 112.406 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.586 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.278 0.0 OUTLIER -66.39 -30.29 70.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.894 1.331 . . . . 0.0 108.411 178.796 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.276 1.8 tt0 -40.15 -62.75 0.7 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 113.943 -1.48 . . . . 0.0 112.301 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.829 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.1 m-20 -88.59 17.08 5.73 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.682 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -114.74 123.5 70.49 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 O-C-N 121.743 -0.598 . . . . 0.0 110.998 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.832 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -117.55 175.11 5.79 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 66.8 m-85 -122.82 150.29 43.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.072 -1.018 . . . . 0.0 111.678 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.756 ' HB2' HG22 ' A' ' 28' ' ' VAL . 28.0 m-85 -131.78 154.78 48.73 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.43 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.05 -39.9 82.92 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -139.6 167.28 22.45 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 122.467 1.127 . . . . 0.0 110.639 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -65.43 -23.34 66.92 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.175 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.613 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.0 -37.11 72.68 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.746 -1.221 . . . . 0.0 109.054 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 32.8 tp10 -62.04 -49.36 76.33 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 177.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.764 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.35 -43.18 92.85 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.798 HD21 ' HG3' ' A' ' 68' ' ' PRO . 51.2 mt -60.61 -28.54 68.59 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.03 -18.61 55.65 Favored 'General case' 0 C--N 1.311 -1.091 0 O-C-N 121.714 -0.616 . . . . 0.0 109.935 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -76.97 0.24 21.86 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.283 -0.886 . . . . 0.0 110.392 179.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 35.8 20.66 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 22.3 m-85 -107.99 162.29 14.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.323 -1.104 . . . . 0.0 111.875 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.71 111.7 62.21 Favored Pre-proline 0 C--N 1.301 -1.508 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.798 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.5 Cg_endo -61.39 136.65 65.12 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 123.535 1.282 . . . . 0.0 110.685 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 38' ' ' SMC . 2.0 t -61.99 112.79 2.47 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.518 ' N ' ' OP1' ' C' ' 233' ' ' ' DA' . 2.8 tptt -53.33 -2.85 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.781 . . . . 0.0 112.083 -178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 69' ' ' CYS . 2.8 tpt180 -100.32 -39.02 8.21 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 122.383 1.087 . . . . 0.0 108.225 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.3 m -91.51 -16.72 26.79 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.595 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 32.8 tp60 -82.11 -47.82 0.95 Allowed Pre-proline 0 C--N 1.299 -1.594 0 O-C-N 121.265 -0.897 . . . . 0.0 112.406 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.451 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 49.5 Cg_endo -76.06 -26.04 9.67 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 122.927 0.962 . . . . 0.0 112.373 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.647 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 53.1 p-10 -74.88 177.87 5.95 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.666 -1.271 . . . . 0.0 110.489 -179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . 2.7 mppt? -109.04 140.13 43.0 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.21 -0.931 . . . . 0.0 112.118 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.914 ' HB2' ' HD2' ' A' ' 39' ' ' ARG . . . -98.33 -132.85 0.23 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.511 -0.743 . . . . 0.0 109.538 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.962 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.8 m120 -58.15 -30.5 7.92 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 119.971 -1.706 . . . . 0.0 110.112 177.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.962 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 42.2 Cg_endo -60.14 -17.39 45.4 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 N-CA-C 107.706 -1.69 . . . . 0.0 107.706 175.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.571 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -43.48 -70.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.716 0.77 . . . . 0.0 109.47 178.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -48.47 -35.03 12.14 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.599 -0.688 . . . . 0.0 112.25 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -69.49 -43.48 73.07 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.824 -1.173 . . . . 0.0 109.894 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -25.69 66.04 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.996 -1.065 . . . . 0.0 108.749 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.952 HD21 HG22 ' A' ' 123' ' ' THR . 1.7 mm? -78.13 -30.09 49.14 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 118.654 -1.218 . . . . 0.0 108.799 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -37.57 81.81 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -50.95 72.13 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.612 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.797 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.48 -38.02 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.608 0 O-C-N 120.693 -1.254 . . . . 0.0 110.504 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.733 HG23 ' CD1' ' A' ' 135' ' ' TRP . 29.4 m -53.52 -45.97 69.93 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.09 -1.631 . . . . 0.0 107.411 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -55.53 -37.02 67.38 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.67 -38.14 66.6 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 177.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 12.7 t -62.18 -51.32 68.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.368 -1.333 . . . . 0.0 108.631 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 ttp180 -47.65 -54.3 12.37 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 93' ' ' LEU . 4.5 mm? -56.14 -36.07 67.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.712 -0.618 . . . . 0.0 111.513 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.51 -10.6 56.65 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.126 0.489 . . . . 0.0 110.295 -177.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.497 ' CG ' ' HG3' ' A' ' 136' ' ' ARG . 0.2 OUTLIER -138.4 -5.48 1.6 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 178.004 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.8 tt0 -90.45 -45.27 9.08 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.249 -0.907 . . . . 0.0 110.881 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.474 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 15.1 pt-20 -87.34 -155.49 0.29 Allowed 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.501 -1.28 . . . . 0.0 110.401 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.655 ' HB ' ' HD3' ' A' ' 99' ' ' PRO . 3.0 m -104.89 -59.89 0.06 OUTLIER Pre-proline 0 N--CA 1.489 1.483 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.655 ' HD3' ' HB ' ' A' ' 98' ' ' THR . 41.6 Cg_endo -67.21 127.18 16.23 Favored 'Trans proline' 0 C--N 1.316 -1.183 0 N-CA-C 107.452 -1.788 . . . . 0.0 107.452 174.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.534 HG13 ' HA ' ' A' ' 94' ' ' LEU . 3.6 t -78.78 146.87 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 119.791 -1.818 . . . . 0.0 109.591 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.75 97.11 6.07 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 117.614 -1.634 . . . . 0.0 112.41 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.653 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -133.96 -47.96 0.8 Allowed 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 102.305 -3.22 . . . . 0.0 102.305 176.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.5 OUTLIER -37.04 -45.18 0.57 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.727 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -42.32 86.46 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.045 -1.659 . . . . 0.0 109.997 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.949 HD23 HD11 ' A' ' 116' ' ' LEU . 2.4 tp -70.94 -40.95 71.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.053 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -67.31 -37.29 83.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 109.866 179.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.8 m-20 -66.67 -40.24 88.5 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.349 -0.844 . . . . 0.0 110.189 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -46.05 78.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.902 . . . . 0.0 110.452 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.781 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 39.6 t -75.53 -18.01 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.241 -0.912 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.26 0.35 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.554 -0.716 . . . . 0.0 110.87 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.651 ' HE3' ' HA ' ' A' ' 116' ' ' LEU . 24.6 ptt? -128.51 169.71 14.04 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.103 -0.998 . . . . 0.0 111.159 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.431 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -72.55 170.61 12.47 Favored Pre-proline 0 N--CA 1.499 1.976 0 O-C-N 121.618 -0.676 . . . . 0.0 111.564 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.431 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 38.2 Cg_endo -63.39 -28.95 71.73 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.91 1.479 . . . . 0.0 109.343 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.578 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 11.2 m-30 -69.49 -41.59 75.9 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.431 -1.307 . . . . 0.0 108.831 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.878 ' CE1' " H2'" ' B' ' 201' ' ' ' DC' . 3.0 t60 -70.92 -24.77 62.52 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 116.775 -1.97 . . . . 0.0 110.906 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.949 HD11 HD23 ' A' ' 105' ' ' LEU . 0.9 OUTLIER -66.86 -40.46 87.89 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 128' ' ' PRO . 31.8 m170 -63.6 -39.4 94.28 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.534 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 3.8 mtp85 -59.84 -35.04 73.91 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.388 -0.82 . . . . 0.0 109.53 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.647 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.1 tm? -69.85 -44.95 68.83 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.047 -1.033 . . . . 0.0 108.677 177.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.71 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.261 0.3 OUTLIER -49.66 -39.08 35.07 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.241 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.953 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.9 OUTLIER -75.91 -38.93 57.23 Favored 'General case' 0 N--CA 1.518 2.971 0 O-C-N 120.947 -1.096 . . . . 0.0 110.048 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.47 57.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.576 -0.703 . . . . 0.0 109.162 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.952 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.48 -59.17 3.16 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.604 -0.685 . . . . 0.0 109.588 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.931 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -51.31 -32.65 25.82 Favored 'General case' 0 N--CA 1.519 2.975 0 O-C-N 120.793 -1.192 . . . . 0.0 108.224 176.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.505 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.72 -40.0 2.7 Favored Glycine 0 N--CA 1.494 2.519 0 CA-C-O 118.037 -1.424 . . . . 0.0 114.331 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.505 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 31.1 mtm -159.25 49.15 0.33 Allowed 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 122.826 3.313 . . . . 0.0 115.232 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.96 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -170.81 85.25 0.52 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 120.352 -1.467 . . . . 0.0 110.07 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.953 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 54.3 Cg_endo -72.11 -103.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 122.47 0.721 . . . . 0.0 113.117 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 1.031 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 16.9 tttp -59.16 -26.22 64.58 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.308 -0.87 . . . . 0.0 110.673 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.64 -35.45 77.29 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.295 -0.878 . . . . 0.0 109.228 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.96 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.31 -35.65 81.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.569 -1.332 . . . . 0.0 107.835 176.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.649 ' OE1' HD13 ' A' ' 94' ' ' LEU . 32.1 tp60 -67.37 -46.17 74.14 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.49 -47.15 85.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 111.081 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.89 -60.12 3.91 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.104 -0.998 . . . . 0.0 110.827 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.733 ' CD1' HG23 ' A' ' 88' ' ' THR . 0.0 OUTLIER -44.91 -48.92 11.26 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 121.865 0.841 . . . . 0.0 110.092 179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.497 ' HG3' ' CG ' ' A' ' 95' ' ' GLU . 19.5 ttm180 -58.89 -39.07 80.35 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.41 0.624 . . . . 0.0 110.048 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.09 -35.23 80.49 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.469 -0.769 . . . . 0.0 110.429 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -100.54 -1.37 35.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.263 -0.898 . . . . 0.0 109.848 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.432 ' HG2' ' HD3' ' A' ' 92' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.095 -1.003 . . . . 0.0 110.208 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.565 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.258 1 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.565 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.658 3 C3'-C2'-C1' 113.859 7.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.461 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -10.03 1 C3'-C2'-C1' 115.004 8.788 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.461 " O5'" H2'' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.402 2 C3'-C2'-C1' 115.043 8.816 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.577 ' N1 ' ' N1 ' ' C' ' 233' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.848 1 C3'-C2'-C1' 114.742 8.602 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.558 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.439 8.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.622 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.777 1 C3'-C2'-C1' 114.005 8.075 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.622 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.212 2 C3'-C2'-C1' 114.776 8.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.617 " H4'" ' HG3' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.83 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.552 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.685 1 C3'-C2'-C1' 115.135 8.882 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.383 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.878 " H2'" ' CE1' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.408 -10.953 1 C3'-C2'-C1' 114.48 8.414 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.679 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.409 -10.907 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.619 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.516 2 C3'-C2'-C1' 114.556 8.469 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.264 2 C3'-C2'-C1' 115.839 9.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.667 2 C3'-C2'-C1' 115.011 8.793 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.503 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.814 2 C3'-C2'-C1' 114.85 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.492 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.373 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.47 H2'' " O5'" ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.019 2 C3'-C2'-C1' 114.368 8.334 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.609 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.288 1 C3'-C2'-C1' 114.574 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.613 ' OP1' ' HE3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.209 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 1.031 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.205 1 C3'-C2'-C1' 114.786 8.633 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.477 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.298 1 C3'-C2'-C1' 115.038 8.813 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.534 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.905 1 C3'-C2'-C1' 114.318 8.298 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.522 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.114 1 C3'-C2'-C1' 115.309 9.006 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.497 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.755 2 C3'-C2'-C1' 114.724 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.44 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.658 1 C3'-C2'-C1' 114.829 8.664 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.469 H2'' " O5'" ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.419 -9.912 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.659 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.828 2 C3'-C2'-C1' 114.86 8.686 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.659 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.355 2 C3'-C2'-C1' 114.843 8.674 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.577 ' N1 ' ' N1 ' ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.401 -11.689 2 C3'-C2'-C1' 114.125 8.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.934 " H4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.411 -10.683 2 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 1.177 ' OP1' ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.41 -10.845 2 C3'-C2'-C1' 115.563 9.188 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.488 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 2 C3'-C2'-C1' 114.787 8.634 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.414 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.665 2 C3'-C2'-C1' 114.531 8.45 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.414 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.309 8.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.076 0.465 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.88 -44.14 0.48 Allowed 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.484 -0.76 . . . . 0.0 111.405 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.76 118.64 2.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.971 -1.081 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.07 -154.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.425 -0.797 . . . . 0.0 110.011 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -71.83 41.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.214 -0.929 . . . . 0.0 111.208 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 79.53 94.12 0.05 Allowed 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.316 -0.865 . . . . 0.0 109.883 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.5 -19.73 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 111.477 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.1 m -79.79 64.23 4.58 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.735 -1.228 . . . . 0.0 109.292 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 54' ' ' PHE . 1.5 p30 -46.78 -30.02 2.22 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.57 -46.48 86.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.677 ' H ' HG22 ' A' ' 8' ' ' THR . 0.5 OUTLIER -82.69 -31.04 28.79 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 117.552 -1.659 . . . . 0.0 108.944 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -51.74 -41.75 61.81 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.036 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 29.1 t-105 -63.05 -40.91 99.12 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.563 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -60.12 -30.38 69.24 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 118.331 -1.347 . . . . 0.0 107.389 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 m -76.03 -35.0 59.67 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.917 0.865 . . . . 0.0 108.801 177.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.786 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 81.8 t -70.32 -26.66 29.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 CA-C-O 122.337 1.065 . . . . 0.0 110.797 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.036 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.26 1.2 mt -95.08 -32.33 13.15 Favored 'General case' 0 C--N 1.266 -3.05 0 CA-C-O 122.302 1.048 . . . . 0.0 108.238 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.751 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -73.95 -11.91 60.49 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.908 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.751 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 61.56 37.99 15.9 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.848 0.832 . . . . 0.0 109.297 -179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.42 ' C ' ' H ' ' A' ' 22' ' ' ASN . 25.6 t0 -64.42 110.09 3.57 Favored Pre-proline 0 C--N 1.3 -1.553 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.611 179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.9 Cg_endo -70.97 6.08 1.88 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 123.562 1.296 . . . . 0.0 109.332 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.305 1.2 t30 -106.96 -11.46 15.68 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 121.93 0.871 . . . . 0.0 109.424 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.621 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -110.01 -5.75 15.34 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-O 122.17 0.986 . . . . 0.0 108.415 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.9 t0 -77.8 128.29 33.76 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.766 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.89 -30.03 11.22 Favored Glycine 0 N--CA 1.504 3.233 0 N-CA-C 106.194 -2.762 . . . . 0.0 106.194 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.2 tt0 -79.55 -49.41 12.27 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.865 -0.785 . . . . 0.0 109.167 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.624 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 3.5 p90 -142.56 170.33 15.91 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 122.301 1.048 . . . . 0.0 110.957 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.3 m -126.58 175.84 7.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.7 120.12 14.91 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 118.206 -1.398 . . . . 0.0 109.208 176.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -100.8 114.79 28.91 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.064 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.935 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.56 111.14 21.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 177.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.271 22.5 mtt-85 -68.76 -20.03 64.34 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.872 0.844 . . . . 0.0 111.143 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.935 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.59 -32.3 73.8 Favored 'General case' 0 C--N 1.289 -2.065 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.615 HG22 ' HB ' ' A' ' 31' ' ' VAL . 9.0 t -118.7 2.37 11.67 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.57 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 59.48 35.86 87.04 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.915 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 53.5 mt -123.66 164.13 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.268 -1.136 . . . . 0.0 109.395 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.5 p90 -146.99 119.58 8.52 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.516 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.702 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.289 14.0 mtm180 -85.71 167.28 25.43 Favored Pre-proline 0 C--N 1.286 -2.155 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.786 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.7 Cg_endo -65.86 -16.01 51.22 Favored 'Trans proline' 0 C--N 1.29 -2.524 0 O-C-N 123.175 1.092 . . . . 0.0 110.405 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 25.1 p -115.27 30.68 7.19 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.692 -1.255 . . . . 0.0 112.061 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.0 t -46.17 139.41 4.63 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.899 -1.126 . . . . 0.0 111.105 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.486 ' HD3' " H5'" ' B' ' 199' ' ' ' DA' . 1.0 OUTLIER -100.98 1.08 39.33 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.338 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.694 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.41 -50.93 5.68 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.353 -1.467 . . . . 0.0 113.285 -177.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.621 ' HB3' " H5'" ' C' ' 234' ' ' ' DT' . 0.0 OUTLIER 174.55 178.14 0.13 Allowed 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 -179.195 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.866 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.9 m-70 -140.24 157.64 45.27 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.255 -1.528 . . . . 0.0 115.108 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.677 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.19 151.29 39.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.482 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.1 mt -49.76 161.38 0.24 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.272 -0.893 . . . . 0.0 111.913 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.611 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.279 8.0 ttm180 -64.23 -30.24 71.31 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 122.837 1.303 . . . . 0.0 108.863 179.108 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.272 0.6 OUTLIER -38.17 -62.82 0.54 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.112 -179.361 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.825 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.4 m-20 -92.75 17.25 10.67 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.68 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -113.45 125.64 70.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 O-C-N 121.497 -0.752 . . . . 0.0 111.578 -178.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.766 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -119.4 175.12 5.98 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.615 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.8 m-85 -123.67 150.23 44.5 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 120.988 -1.07 . . . . 0.0 111.42 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.751 ' HB2' HG22 ' A' ' 28' ' ' VAL . 48.4 m-85 -131.49 154.87 48.3 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.006 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.65 -39.92 73.35 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -137.56 163.61 30.77 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.544 1.164 . . . . 0.0 110.607 178.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.21 -24.31 67.82 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.265 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.653 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.06 -36.99 72.5 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.657 -1.277 . . . . 0.0 109.001 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.72 -48.91 78.63 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.736 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.43 -43.27 93.11 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.168 0.985 . . . . 0.0 108.468 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt -62.28 -29.25 70.29 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.0 -16.16 55.72 Favored 'General case' 0 C--N 1.312 -1.065 0 O-C-N 121.648 -0.657 . . . . 0.0 110.333 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.46 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -77.61 0.21 24.03 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.89 37.04 9.6 Favored Glycine 0 C--N 1.285 -2.292 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 64' ' ' ALA . 15.1 m-85 -114.54 157.81 22.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -1.078 . . . . 0.0 111.123 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -99.81 121.48 54.2 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 62' ' ' LEU . 31.9 Cg_endo -62.32 139.13 75.57 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.467 1.246 . . . . 0.0 111.0 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.74 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 2.4 t -62.69 118.12 7.22 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.437 0.637 . . . . 0.0 110.231 -177.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 14.0 tptt -56.6 0.42 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.56 -0.712 . . . . 0.0 111.554 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' CYS 0.25 2.3 tpt180 -107.13 -36.56 6.54 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.671 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 17.8 m -91.8 -19.36 22.64 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.83 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' N ' ' HD2' ' A' ' 74' ' ' PRO . 24.2 tt0 -79.89 -44.16 1.51 Allowed Pre-proline 0 C--N 1.3 -1.561 0 O-C-N 121.576 -0.702 . . . . 0.0 111.564 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 46.7 Cg_endo -76.24 -38.48 1.1 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.968 0.983 . . . . 0.0 110.931 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.702 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -75.29 178.22 5.98 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.102 -0.999 . . . . 0.0 109.971 -179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HE2' ' CD ' ' A' ' 83' ' ' ARG . 3.9 mttp -115.78 140.0 49.63 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 0.0 112.947 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.773 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -88.18 -120.04 0.05 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.028 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.05 -30.5 8.02 Favored Pre-proline 0 N--CA 1.503 2.204 0 O-C-N 120.126 -1.609 . . . . 0.0 109.101 176.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.028 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 51.8 Cg_endo -58.61 -16.66 31.27 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 N-CA-C 107.709 -1.689 . . . . 0.0 107.709 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' A' ' 77' ' ' ALA . 11.5 tpt180 -47.44 -72.54 0.05 Allowed 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.917 0.865 . . . . 0.0 109.205 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 80' ' ' ARG . 16.6 mt-30 -46.63 -35.44 5.94 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.146 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 11.7 t-80 -69.5 -48.0 62.03 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.005 -1.059 . . . . 0.0 110.639 -179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.506 ' CD ' ' HE2' ' A' ' 76' ' ' LYS . 1.4 tpm_? -67.89 -26.71 66.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.822 -1.174 . . . . 0.0 109.975 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.009 HD21 HG22 ' A' ' 123' ' ' THR . 0.3 OUTLIER -77.83 -29.7 50.71 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 117.92 -1.512 . . . . 0.0 107.525 178.804 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 3.4 m-20 -59.99 -37.46 79.75 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 175.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 83' ' ' ARG . 15.8 tppt? -58.42 -48.56 80.31 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.628 -0.67 . . . . 0.0 110.492 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.774 HG13 HD13 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -60.45 -37.63 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.565 0 O-C-N 120.507 -1.371 . . . . 0.0 110.153 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.922 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 27.8 m -54.01 -41.7 68.26 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.037 -1.664 . . . . 0.0 107.276 176.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -55.83 -39.75 71.83 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 1.035 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -55.01 -32.48 61.83 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.922 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.0 OUTLIER -61.65 -52.73 63.13 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.39 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.473 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.1 ttp180 -49.68 -59.23 3.99 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.387 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 3.0 mp -56.28 -36.99 69.24 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.43 -0.794 . . . . 0.0 112.705 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.035 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -69.14 -10.79 59.38 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.535 -0.728 . . . . 0.0 110.972 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HG2' ' OXT' ' A' ' 139' ' ' ARG . 9.3 tp10 -135.34 -9.21 2.23 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.447 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.473 ' N ' ' O ' ' A' ' 92' ' ' ARG . 13.6 tp60 -90.51 -49.95 6.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.407 -0.808 . . . . 0.0 111.506 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.645 ' OE1' ' O ' ' A' ' 99' ' ' PRO . 1.7 pp20? -87.49 -155.4 0.29 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.275 -1.37 . . . . 0.0 110.936 -178.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.585 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 3.2 m -105.02 -66.49 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 111.216 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.645 ' O ' ' OE1' ' A' ' 97' ' ' GLU . 40.3 Cg_endo -66.52 124.28 12.22 Favored 'Trans proline' 0 N--CA 1.491 1.358 0 N-CA-C 108.457 -1.401 . . . . 0.0 108.457 176.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.955 ' CG1' HD23 ' A' ' 94' ' ' LEU . 1.7 t -78.16 143.5 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 120.005 -1.685 . . . . 0.0 110.087 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.89 98.51 7.8 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.983 1.373 . . . . 0.0 112.188 -178.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.746 HD11 ' CB ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -132.59 -46.36 0.89 Allowed 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 103.659 -2.719 . . . . 0.0 103.659 176.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -43.42 1.74 Allowed 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.756 178.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.49 -42.6 92.0 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.569 -1.332 . . . . 0.0 110.436 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.809 HD23 HD21 ' A' ' 116' ' ' LEU . 1.2 tp -72.26 -39.82 68.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -66.06 -39.22 89.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.888 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.16 -40.18 90.33 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.335 -0.853 . . . . 0.0 110.277 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -65.37 -45.05 85.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.246 -0.909 . . . . 0.0 110.748 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 6.5 t -79.58 -15.53 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.072 -1.018 . . . . 0.0 110.843 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.62 31.71 0.25 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.523 -0.735 . . . . 0.0 110.5 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.631 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 15.5 ptt? -132.18 166.24 22.28 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.398 -0.814 . . . . 0.0 110.795 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.455 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 0.9 OUTLIER -72.98 170.31 14.16 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.603 -0.686 . . . . 0.0 111.586 -179.337 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.87 -28.75 67.46 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.919 1.484 . . . . 0.0 109.75 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.608 ' O ' ' HG2' ' A' ' 118' ' ' ARG . 11.8 m-30 -69.46 -42.13 75.32 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.557 -1.257 . . . . 0.0 108.463 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.747 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 6.0 t-80 -70.48 -25.0 62.96 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 117.207 -1.797 . . . . 0.0 110.885 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.809 HD21 HD23 ' A' ' 105' ' ' LEU . 1.4 tm? -65.17 -40.4 94.25 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 176.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.502 ' HB3' ' N ' ' A' ' 129' ' ' LYS . 22.0 m170 -61.25 -44.14 97.73 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.621 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 14.0 mmm180 -57.11 -34.92 68.84 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.513 -0.742 . . . . 0.0 109.709 177.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.7 tm? -69.61 -48.41 60.18 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.037 -1.039 . . . . 0.0 109.079 177.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.672 ' CZ ' HG22 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -49.86 -38.56 35.84 Favored 'General case' 0 N--CA 1.518 2.948 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.876 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.9 ttpt -74.25 -41.09 61.86 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.887 -1.133 . . . . 0.0 110.309 177.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.38 -53.22 60.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.436 -0.79 . . . . 0.0 109.167 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 1.009 HG22 HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.4 -60.39 2.37 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.588 -0.695 . . . . 0.0 109.712 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.803 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -51.78 -32.5 31.38 Favored 'General case' 0 N--CA 1.52 3.053 0 O-C-N 120.754 -1.216 . . . . 0.0 107.869 176.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.597 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 111.12 -39.85 2.75 Favored Glycine 0 N--CA 1.492 2.427 0 CA-C-O 117.699 -1.612 . . . . 0.0 115.106 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.597 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 18.6 mmm -156.66 49.41 0.47 Allowed 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 123.498 3.649 . . . . 0.0 116.052 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.018 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.57 82.58 0.56 Allowed Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 119.852 -1.78 . . . . 0.0 111.64 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.876 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.0 Cg_endo -72.57 -107.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 118.159 -0.761 . . . . 0.0 113.108 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 1.03 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 5.9 tptp -60.05 -22.73 63.04 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.952 -1.092 . . . . 0.0 110.996 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.457 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.77 -35.86 77.6 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.742 -1.223 . . . . 0.0 108.725 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.018 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.4 -33.8 76.69 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.857 ' HA ' ' CD1' ' A' ' 135' ' ' TRP . 10.8 tm0? -62.35 -34.22 76.23 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.2 -46.63 73.32 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 137' ' ' ALA . . . -58.43 -39.67 80.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.857 ' CD1' ' HA ' ' A' ' 132' ' ' GLN 0.251 0.1 OUTLIER -53.21 -52.22 59.59 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 177.154 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -62.16 -23.81 66.81 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.239 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 134' ' ' ALA . . . -76.91 -38.34 53.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.117 -0.99 . . . . 0.0 110.095 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -83.81 -27.43 28.8 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 121.382 -0.824 . . . . 0.0 108.785 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.469 ' NH1' ' HA ' ' A' ' 92' ' ' ARG . 14.5 ttm105 . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.85 -1.156 . . . . 0.0 110.34 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.534 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.301 1 C3'-C2'-C1' 114.709 8.578 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.534 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.663 2 C3'-C2'-C1' 113.764 7.903 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.439 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.988 1 C3'-C2'-C1' 114.873 8.695 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.519 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.961 8.758 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.519 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.05 2 C3'-C2'-C1' 114.738 8.598 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.661 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.97 2 C3'-C2'-C1' 114.185 8.204 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.661 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.41 -10.833 2 C3'-C2'-C1' 114.266 8.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.596 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.037 2 C3'-C2'-C1' 114.922 8.73 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.439 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.963 2 C3'-C2'-C1' 114.601 8.501 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.565 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.77 1 C3'-C2'-C1' 115.132 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.565 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.982 2 C3'-C2'-C1' 114.517 8.441 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.747 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.721 1 C3'-C2'-C1' 114.617 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.663 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.818 1 C3'-C2'-C1' 114.616 8.512 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.595 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.58 2 C3'-C2'-C1' 114.679 8.557 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.195 2 C3'-C2'-C1' 115.729 9.306 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.596 2 C3'-C2'-C1' 114.858 8.684 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.508 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.422 -9.63 2 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.508 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.201 2 C3'-C2'-C1' 114.733 8.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.349 2 C3'-C2'-C1' 114.337 8.312 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.602 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.272 2 C3'-C2'-C1' 114.644 8.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.602 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.219 2 C3'-C2'-C1' 114.749 8.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 1.03 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.417 -10.119 1 C3'-C2'-C1' 114.929 8.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.459 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.025 1 C3'-C2'-C1' 114.999 8.785 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.621 ' H41' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . 2 C3'--C2' 1.418 -10.041 2 C3'-C2'-C1' 114.578 8.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.615 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.965 1 C3'-C2'-C1' 115.241 8.958 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.509 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.824 2 C3'-C2'-C1' 114.732 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.499 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.435 1 C3'-C2'-C1' 114.728 8.592 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.547 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.03 2 C3'-C2'-C1' 114.713 8.581 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.009 2 C3'-C2'-C1' 114.946 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.446 2 C3'-C2'-C1' 115.073 8.838 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.74 H5'' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.404 -11.384 1 C3'-C2'-C1' 114.515 8.439 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.915 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.709 2 C3'-C2'-C1' 114.841 8.672 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.771 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.717 2 C3'-C2'-C1' 115.561 9.186 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.485 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.4 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.417 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.714 2 C3'-C2'-C1' 114.518 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.417 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.455 2 C3'-C2'-C1' 114.269 8.264 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.37 0.605 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -129.88 167.56 17.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.271 -0.893 . . . . 0.0 110.072 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.9 123.15 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.264 -0.898 . . . . 0.0 110.242 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -82.34 -158.65 0.26 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.284 -0.885 . . . . 0.0 109.901 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.567 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -75.27 51.63 0.56 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.27 -0.894 . . . . 0.0 110.813 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.567 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.7 t 79.55 68.45 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.593 -0.692 . . . . 0.0 109.978 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.07 30.06 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.318 -0.864 . . . . 0.0 111.003 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.645 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.6 m -104.98 64.16 0.72 Allowed 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.219 -0.993 . . . . 0.0 109.294 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.1 p-10 -47.34 -29.96 2.88 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 119.98 -0.688 . . . . 0.0 109.315 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 13' ' ' TRP . 14.2 m-20 -58.63 -45.43 89.28 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' H ' HG22 ' A' ' 8' ' ' THR . 0.9 OUTLIER -79.46 -27.42 41.6 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.674 177.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.918 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -55.83 -40.69 73.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.071 ' NE1' HD11 ' A' ' 17' ' ' LEU . 21.9 t-105 -60.34 -40.57 91.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 3.9 tt0 -64.15 -29.94 71.03 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 177.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.437 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -71.79 -31.39 66.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.467 1.127 . . . . 0.0 108.421 177.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.956 HG12 ' HE1' ' A' ' 46' ' ' HIS . 48.9 t -75.27 -38.12 40.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 122.191 0.996 . . . . 0.0 111.837 -178.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.071 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.254 5.1 mt -83.92 -33.21 24.76 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-O 122.169 0.985 . . . . 0.0 108.977 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.712 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -78.15 -16.89 57.52 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.622 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.712 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.65 39.82 2.66 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.872 0.844 . . . . 0.0 109.921 -179.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 22' ' ' ASN . 22.6 t70 -63.05 109.43 2.45 Favored Pre-proline 0 C--N 1.299 -1.629 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.493 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 45.0 Cg_endo -69.31 6.29 1.21 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.67 1.353 . . . . 0.0 110.014 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.303 1.3 t30 -105.0 -11.25 16.73 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.934 0.873 . . . . 0.0 109.272 -178.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.805 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.83 -5.91 15.41 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.111 0.957 . . . . 0.0 108.5 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.781 ' C ' ' HB1' ' A' ' 77' ' ' ALA . 30.3 t0 -79.22 129.35 34.36 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.735 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -25.76 27.16 Favored Glycine 0 N--CA 1.504 3.199 0 N-CA-C 106.145 -2.782 . . . . 0.0 106.145 -176.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.2 tm-20 -85.73 -51.08 6.67 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 121.903 -0.763 . . . . 0.0 109.405 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.805 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 20.9 p90 -141.82 170.28 16.01 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 122.462 1.125 . . . . 0.0 111.552 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.777 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -125.85 175.96 7.2 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.946 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.8 OUTLIER -138.26 119.94 15.15 Favored 'General case' 0 C--N 1.28 -2.456 0 C-N-CA 118.08 -1.448 . . . . 0.0 108.929 176.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.612 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -96.15 113.64 25.26 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.587 -1.188 . . . . 0.0 113.233 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.021 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.57 106.97 17.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.272 13.4 mtm180 -67.98 -19.87 64.98 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.914 0.864 . . . . 0.0 111.268 -179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.021 HG22 HG12 ' A' ' 31' ' ' VAL . 3.2 t -67.53 -31.69 71.96 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 121.696 0.76 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.612 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.9 t -118.27 3.72 11.94 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.676 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.416 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 59.21 35.78 85.89 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.76 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.7 mt -124.85 165.44 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.287 -1.125 . . . . 0.0 108.967 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.737 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.4 p90 -149.03 117.91 6.68 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 175.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.487 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.626 ' NH2' ' OD1' ' A' ' 75' ' ' ASP 0.262 0.0 OUTLIER -87.26 171.73 9.34 Favored Pre-proline 0 C--N 1.286 -2.169 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 177.701 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.698 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 38.8 Cg_endo -66.77 -15.52 47.55 Favored 'Trans proline' 0 C--N 1.291 -2.452 0 O-C-N 123.219 1.115 . . . . 0.0 110.811 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.709 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 24.9 p -115.37 30.84 7.09 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.719 -1.238 . . . . 0.0 112.867 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 52.3 t -47.45 135.73 10.57 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.805 -1.184 . . . . 0.0 110.21 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.442 ' HG3' ' NH1' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.89 4.53 42.78 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.056 -179.53 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.677 ' HB1' " O4'" ' C' ' 233' ' ' ' DA' . . . -90.17 -50.85 5.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.411 -1.431 . . . . 0.0 111.746 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.622 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 172.47 -176.43 0.06 Allowed 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 1.047 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.9 m-70 -137.4 159.58 41.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.309 -1.495 . . . . 0.0 113.878 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.808 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -114.28 169.61 8.9 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.294 177.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.23 152.09 34.37 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.363 -0.835 . . . . 0.0 112.092 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.291 20.6 ttm180 -62.19 -30.31 70.99 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 122.915 1.341 . . . . 0.0 108.218 178.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.264 1.8 tm-20 -40.56 -66.32 0.33 Allowed 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 113.856 -1.52 . . . . 0.0 112.378 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.766 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 78.7 m-20 -88.7 16.97 5.93 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.542 0.686 . . . . 0.0 109.193 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.751 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -108.92 121.49 62.1 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.632 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.37 175.39 6.18 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.605 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 71.3 m-85 -120.02 150.38 40.64 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.013 -1.055 . . . . 0.0 112.022 -177.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.777 ' HB2' HG22 ' A' ' 28' ' ' VAL . 16.1 m-85 -129.7 154.81 46.79 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.543 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.86 -39.72 72.73 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.5 p30 -137.66 162.56 33.51 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.645 1.212 . . . . 0.0 110.908 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.2 -23.37 67.28 Favored 'General case' 0 C--N 1.282 -2.342 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.202 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.609 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.3 -36.89 71.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.615 -1.303 . . . . 0.0 108.925 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.464 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 14.2 tp10 -61.83 -49.29 76.88 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 177.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.737 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.7 -43.3 89.99 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 177.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 65.6 mt -63.82 -27.25 69.05 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.4 -17.74 53.75 Favored 'General case' 0 C--N 1.311 -1.069 0 O-C-N 121.598 -0.689 . . . . 0.0 110.26 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.515 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.69 0.47 23.3 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.0 0.905 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.66 32.92 23.31 Favored Glycine 0 C--N 1.284 -2.34 0 N-CA-C 109.171 -1.572 . . . . 0.0 109.171 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.515 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 17.9 m-85 -106.86 158.81 16.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.102 . . . . 0.0 110.927 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -99.94 120.7 56.35 Favored Pre-proline 0 C--N 1.299 -1.61 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.656 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.8 Cg_endo -62.76 140.17 78.86 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.496 1.261 . . . . 0.0 110.329 -178.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.583 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 2.9 t -63.9 117.87 7.59 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.331 0.586 . . . . 0.0 110.33 -177.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 5.1 tttm -52.06 -6.85 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.368 -0.832 . . . . 0.0 111.79 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NH1' ' HG3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -101.18 -38.08 8.27 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.463 1.125 . . . . 0.0 108.637 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.615 ' HA ' ' OD2' ' A' ' 75' ' ' ASP . 8.8 m -89.32 -18.59 26.64 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.501 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 36.2 tt0 -79.92 -43.81 1.5 Allowed Pre-proline 0 C--N 1.297 -1.703 0 O-C-N 121.565 -0.71 . . . . 0.0 111.98 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -79.62 -24.94 5.81 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 122.967 0.983 . . . . 0.0 112.169 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD1' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -79.87 178.08 8.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.767 -1.208 . . . . 0.0 110.939 -178.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.423 ' HD2' ' HB2' ' A' ' 79' ' ' PRO . 24.6 mmtm -117.37 131.44 56.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.279 -0.888 . . . . 0.0 111.153 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.781 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -84.5 -119.79 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.57 -0.706 . . . . 0.0 109.733 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.996 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -57.57 -30.68 8.29 Favored Pre-proline 0 N--CA 1.498 1.961 0 O-C-N 119.728 -1.858 . . . . 0.0 108.896 176.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.996 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 55.7 Cg_endo -61.91 -14.1 34.89 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 108.476 -1.394 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.728 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 7.0 ttm180 -51.92 -62.67 1.48 Allowed 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.506 -0.746 . . . . 0.0 109.119 179.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -51.77 -34.79 41.15 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.304 -0.872 . . . . 0.0 111.579 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.9 t-80 -69.24 -43.41 74.06 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.186 -0.946 . . . . 0.0 109.756 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -67.72 -26.82 66.35 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.933 -1.105 . . . . 0.0 109.101 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 124' ' ' THR . 0.6 OUTLIER -77.95 -29.58 49.98 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.259 -1.376 . . . . 0.0 107.966 178.782 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 6.0 m-20 -61.11 -37.76 83.91 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 175.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.93 67.38 Favored 'General case' 0 N--CA 1.5 2.035 0 CA-C-O 121.745 0.783 . . . . 0.0 109.365 177.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.805 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 22.7 mm -50.23 -45.22 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.113 -0.992 . . . . 0.0 110.798 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 47.4 m -51.33 -45.27 62.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.271 -1.518 . . . . 0.0 108.126 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -55.95 -37.67 69.31 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.752 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.95 -36.95 65.87 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.663 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.36 -58.87 6.08 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.979 178.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' GLN . 15.7 ttp180 -42.97 -56.97 3.05 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.541 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.585 HD21 HG21 ' A' ' 101' ' ' THR . 16.5 tp -56.31 -36.49 68.75 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.53 -0.731 . . . . 0.0 111.821 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.634 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.3 OUTLIER -68.8 -10.59 57.6 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.785 -0.572 . . . . 0.0 110.764 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 10.4 tp10 -137.43 -5.86 1.79 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.22 -0.925 . . . . 0.0 110.53 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 92' ' ' ARG . 16.1 tt0 -90.16 -37.51 14.13 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 121.154 -0.966 . . . . 0.0 110.181 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.581 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 10.8 pt-20 -85.86 -155.56 0.24 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 118.445 -1.302 . . . . 0.0 109.938 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.566 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.2 m -105.09 -66.09 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.319 -0.863 . . . . 0.0 108.906 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.581 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 39.8 Cg_endo -66.33 140.15 57.3 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 107.78 -1.661 . . . . 0.0 107.78 173.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -78.55 154.94 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 120.02 -1.675 . . . . 0.0 110.244 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.585 HG21 HD21 ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.96 98.63 7.3 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.713 -179.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.853 HD21 ' NE2' ' A' ' 117' ' ' HIS . 0.2 OUTLIER -132.02 -47.86 0.94 Allowed 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 176.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -40.44 -45.05 2.13 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.148 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.39 84.54 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.607 -1.308 . . . . 0.0 110.694 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.814 HD23 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -75.01 -41.38 59.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.162 -0.961 . . . . 0.0 109.943 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.827 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -61.55 -44.74 96.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.337 -0.852 . . . . 0.0 109.602 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -41.8 96.6 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 121.467 -0.771 . . . . 0.0 109.612 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -56.87 -62.73 1.54 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.289 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.745 ' O ' ' HB2' ' A' ' 110' ' ' ALA . 22.1 t -59.45 -65.34 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.31 -0.869 . . . . 0.0 109.213 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.745 ' HB2' ' O ' ' A' ' 109' ' ' VAL . . . 138.71 30.57 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.904 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.827 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 3.0 ptt? -140.17 175.04 9.92 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.893 -1.129 . . . . 0.0 111.821 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.427 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -73.07 170.76 12.42 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 121.799 -0.563 . . . . 0.0 111.33 -179.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.62 ' CB ' HD22 ' A' ' 102' ' ' LEU . 37.6 Cg_endo -62.23 -33.24 81.7 Favored 'Trans proline' 0 N--CA 1.487 1.12 0 O-C-N 123.799 1.421 . . . . 0.0 110.391 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.582 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.47 -42.3 75.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.268 -1.373 . . . . 0.0 109.34 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.8 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 7.3 t60 -70.7 -24.39 62.65 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 116.496 -2.082 . . . . 0.0 110.53 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.814 HD21 HD23 ' A' ' 105' ' ' LEU . 2.8 tm? -63.23 -43.22 98.68 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 176.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.853 ' NE2' HD21 ' A' ' 102' ' ' LEU . 74.0 m-70 -60.01 -42.59 94.61 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.578 HH22 ' H71' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -58.84 -35.14 72.43 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.495 -0.753 . . . . 0.0 109.704 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' C ' HD13 ' A' ' 119' ' ' LEU . 1.4 tm? -70.13 -46.9 63.79 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 120.952 -1.093 . . . . 0.0 108.844 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.805 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.287 0.3 OUTLIER -49.75 -39.89 39.13 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.516 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.819 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.0 OUTLIER -76.54 -38.39 55.14 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.889 -1.132 . . . . 0.0 110.128 177.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.53 -55.32 35.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.2 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.77 HG22 ' CD2' ' A' ' 84' ' ' LEU . 1.3 m -69.2 -58.95 3.37 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 119.637 -0.825 . . . . 0.0 109.823 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.822 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.3 t -49.75 -32.18 13.12 Favored 'General case' 0 N--CA 1.52 3.074 0 O-C-N 120.591 -1.318 . . . . 0.0 107.792 175.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.24 -40.2 2.63 Favored Glycine 0 N--CA 1.492 2.381 0 CA-C-O 117.582 -1.677 . . . . 0.0 114.732 179.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 125' ' ' GLY . 1.4 mpp? -159.76 48.97 0.3 Allowed 'General case' 0 N--CA 1.519 3.021 0 CA-C-N 123.412 3.606 . . . . 0.0 115.684 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.118 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.83 89.02 0.48 Allowed Pre-proline 0 N--CA 1.496 1.838 0 O-C-N 120.0 -1.687 . . . . 0.0 111.236 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.819 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 49.4 Cg_endo -67.17 -116.45 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.409 0.689 . . . . 0.0 113.056 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.945 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 8.8 tptt -57.86 -21.61 43.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.897 -1.127 . . . . 0.0 111.076 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.683 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.45 -41.92 79.56 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.142 -0.974 . . . . 0.0 109.188 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.118 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.8 -38.26 90.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.579 -1.326 . . . . 0.0 108.703 177.122 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.634 ' CD ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -57.0 -49.25 76.35 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.473 179.116 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.55 -44.08 97.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.406 -0.809 . . . . 0.0 110.274 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.56 -60.06 4.41 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.237 -0.914 . . . . 0.0 109.813 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.473 ' HB2' ' SG ' ' A' ' 91' ' ' CYS 0.254 0.0 OUTLIER -44.3 -49.39 9.45 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.983 0.897 . . . . 0.0 109.881 178.348 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 2.4 ttt-85 -59.67 -38.29 81.07 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.03 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.52 -34.28 77.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.417 -0.802 . . . . 0.0 110.427 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -100.48 0.1 38.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.035 -1.041 . . . . 0.0 110.238 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.509 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.346 1 C3'-C2'-C1' 114.686 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.531 H2'' ' OP2' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.402 -11.641 3 C3'-C2'-C1' 113.615 7.796 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.531 ' OP2' H2'' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.415 -10.281 2 C3'-C2'-C1' 115.181 8.915 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.521 " O5'" H2'' ' B' ' 192' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.177 1 C3'-C2'-C1' 114.853 8.681 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.432 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.057 2 C3'-C2'-C1' 114.576 8.483 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.694 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.036 2 C3'-C2'-C1' 114.162 8.187 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.694 " O5'" H2'' ' B' ' 195' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.413 -10.534 2 C3'-C2'-C1' 114.111 8.151 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.602 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.251 2 C3'-C2'-C1' 114.969 8.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.432 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.634 8.524 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.576 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.814 1 C3'-C2'-C1' 115.18 8.914 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.597 H2'' ' C5 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.183 1 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.8 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.41 -10.778 1 C3'-C2'-C1' 114.445 8.389 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.648 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.749 2 C3'-C2'-C1' 114.595 8.497 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.347 2 C3'-C2'-C1' 114.673 8.552 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.531 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.208 2 C3'-C2'-C1' 115.875 9.411 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.531 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.716 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.716 2 C3'-C2'-C1' 114.851 8.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.377 2 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.33 2 C3'-C2'-C1' 114.385 8.346 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.555 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.42 2 C3'-C2'-C1' 114.627 8.519 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.582 ' H73' ' CE2' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.417 -10.133 1 C3'-C2'-C1' 114.755 8.611 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.945 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.422 1 C3'-C2'-C1' 114.96 8.757 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.465 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.15 1 C3'-C2'-C1' 115.052 8.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.465 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.967 1 C3'-C2'-C1' 114.435 8.382 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.531 ' N2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.349 1 C3'-C2'-C1' 115.311 9.008 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.674 2 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.469 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.371 1 C3'-C2'-C1' 114.882 8.701 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.492 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.082 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.865 2 C3'-C2'-C1' 114.886 8.704 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.608 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.164 2 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.677 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.404 -11.43 1 C3'-C2'-C1' 114.581 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 1.047 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.68 2 C3'-C2'-C1' 114.881 8.7 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.866 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.684 1 C3'-C2'-C1' 115.485 9.132 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.501 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 114.657 8.541 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.474 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.78 2 C3'-C2'-C1' 114.674 8.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.4 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.393 2 C3'-C2'-C1' 114.242 8.244 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -140.73 -164.23 1.69 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.332 -0.855 . . . . 0.0 110.222 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -108.8 -165.13 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.368 -0.832 . . . . 0.0 110.311 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.752 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -148.36 -154.17 0.54 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.402 -0.811 . . . . 0.0 109.072 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.542 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.4 m -55.15 46.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.487 -0.758 . . . . 0.0 111.931 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.752 ' N ' ' O ' ' A' ' 4' ' ' ALA . 1.4 t 79.56 96.11 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.527 -0.733 . . . . 0.0 112.36 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 1.4 mt 80.46 77.67 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 121.991 0.9 . . . . 0.0 112.444 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.622 ' OG1' ' HB3' ' A' ' 4' ' ' ALA . 20.3 m -86.66 63.44 7.98 Favored 'General case' 0 C--N 1.289 -2.026 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 176.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.566 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.81 -31.76 0.12 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.598 . . . . 0.0 110.46 -179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.92 -53.61 55.88 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.351 -0.843 . . . . 0.0 109.504 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.558 ' H ' HG22 ' A' ' 8' ' ' THR . 0.2 OUTLIER -83.4 -28.17 29.08 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 117.186 -1.806 . . . . 0.0 109.798 178.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.96 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.02 -43.57 63.77 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 177.358 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.066 ' NE1' HD11 ' A' ' 17' ' ' LEU . 15.6 t-105 -63.39 -40.67 97.85 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.477 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -62.59 -30.04 71.04 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.476 -1.29 . . . . 0.0 108.013 178.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 m -73.59 -29.25 62.28 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.047 HG12 ' HE1' ' A' ' 46' ' ' HIS . 25.6 t -74.0 -40.77 52.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 CA-C-O 122.459 1.123 . . . . 0.0 111.501 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.066 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.259 5.1 mt -80.16 -34.79 37.33 Favored 'General case' 0 C--N 1.262 -3.22 0 CA-C-O 122.291 1.043 . . . . 0.0 108.695 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -78.44 -13.95 59.6 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.206 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 6.2 mtm105 64.57 41.3 5.53 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.483 -0.761 . . . . 0.0 109.616 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ASN . 43.1 t0 -70.0 110.24 6.27 Favored Pre-proline 0 C--N 1.3 -1.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 42.8 Cg_endo -67.52 6.25 0.76 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 O-C-N 123.646 1.34 . . . . 0.0 110.411 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.295 1.2 t30 -99.81 -11.22 20.96 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.993 0.901 . . . . 0.0 109.106 -178.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.74 -5.82 15.49 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.093 0.949 . . . . 0.0 108.672 177.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.824 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.254 30.2 t0 -76.77 126.45 31.0 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 179.71 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.653 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.76 -24.77 30.79 Favored Glycine 0 N--CA 1.504 3.228 0 N-CA-C 107.173 -2.371 . . . . 0.0 107.173 -177.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' ' O ' ' A' ' 56' ' ' ALA . 6.3 tp10 -89.22 -49.21 6.87 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.655 -0.909 . . . . 0.0 110.207 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 5.7 p90 -140.39 170.53 15.63 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.359 1.076 . . . . 0.0 111.101 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.768 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.5 m -125.87 175.88 7.35 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.781 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -140.47 119.98 13.19 Favored 'General case' 0 C--N 1.28 -2.454 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.685 176.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' OG ' ' A' ' 53' ' ' SER . . . -98.12 113.71 25.69 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.614 -175.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.066 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -89.39 103.85 14.45 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.263 13.2 mtp180 -65.32 -19.84 66.13 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.926 0.869 . . . . 0.0 111.237 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.066 HG22 HG12 ' A' ' 31' ' ' VAL . 3.4 t -64.64 -32.08 73.59 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-O 121.799 0.809 . . . . 0.0 108.96 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.563 HG22 ' HB ' ' A' ' 31' ' ' VAL . 8.6 t -119.07 1.71 11.42 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.42 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.07 34.54 89.32 Favored Glycine 0 N--CA 1.486 1.993 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.711 ' CD1' ' OP2' ' C' ' 234' ' ' ' DT' . 77.2 mt -125.02 166.01 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.048 -1.266 . . . . 0.0 109.227 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.9 p90 -148.06 116.65 6.64 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.45 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.693 ' NH2' ' OD2' ' A' ' 75' ' ' ASP 0.254 7.3 mtp180 -86.83 178.15 2.41 Favored Pre-proline 0 C--N 1.285 -2.21 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 177.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.74 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 42.8 Cg_endo -70.35 -20.9 31.48 Favored 'Trans proline' 0 C--N 1.294 -2.309 0 O-C-N 123.185 1.097 . . . . 0.0 111.568 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.626 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 9.8 p -115.01 30.81 7.11 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.736 -1.227 . . . . 0.0 113.095 -177.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 41' ' ' SER . 46.7 t -44.13 139.98 2.3 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.867 -1.146 . . . . 0.0 109.241 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.418 HH11 ' HG2' ' A' ' 71' ' ' ARG . 2.5 ptm180 -100.4 0.58 40.12 Favored 'General case' 0 C--N 1.286 -2.191 0 O-C-N 121.83 -0.544 . . . . 0.0 112.157 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.37 -50.73 5.79 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.197 -1.401 . . . . 0.0 112.681 -178.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.765 ' HB3' " C4'" ' C' ' 234' ' ' ' DT' . 0.1 OUTLIER 173.97 -178.5 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 1.047 ' HE1' HG12 ' A' ' 16' ' ' VAL . 4.1 m-70 -140.04 160.3 40.24 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.794 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.19 152.8 37.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.428 -1.26 . . . . 0.0 108.891 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -47.89 160.79 0.12 Allowed 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.988 -1.07 . . . . 0.0 112.721 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.627 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 1.0 OUTLIER -68.38 -30.26 69.15 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 122.965 1.364 . . . . 0.0 109.092 179.505 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.273 0.8 OUTLIER -38.45 -61.81 0.66 Allowed 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.019 -1.446 . . . . 0.0 112.154 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 77.1 m-20 -90.71 17.13 7.99 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.729 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.33 129.32 65.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 CA-C-O 121.668 0.747 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.781 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -124.55 175.27 7.27 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 79.9 m-85 -123.8 150.1 44.89 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.962 -1.087 . . . . 0.0 111.621 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.768 ' HB2' HG22 ' A' ' 28' ' ' VAL . 30.4 m-85 -131.87 154.88 48.74 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.796 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.0 -39.77 75.68 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.4 p30 -138.44 164.81 28.4 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 122.587 1.184 . . . . 0.0 110.599 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.41 -24.07 67.68 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.155 178.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.607 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.85 -36.19 72.76 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.605 -1.309 . . . . 0.0 109.125 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 27.0 tp10 -62.12 -49.45 75.84 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.705 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.8 -43.13 94.62 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.116 0.96 . . . . 0.0 108.43 177.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.749 HD21 ' HG3' ' A' ' 68' ' ' PRO . 69.0 mt -62.08 -28.32 69.53 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.29 -17.46 54.6 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.635 -0.666 . . . . 0.0 110.296 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.89 0.21 28.19 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.148 -0.97 . . . . 0.0 110.561 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.83 40.81 7.96 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.809 -1.317 . . . . 0.0 109.809 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.406 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 15.2 m-85 -116.85 160.74 20.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.336 -1.096 . . . . 0.0 111.456 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.93 116.99 64.19 Favored Pre-proline 0 C--N 1.3 -1.576 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.749 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.6 Cg_endo -62.61 136.79 60.4 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.54 1.284 . . . . 0.0 110.76 -178.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.523 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 1.9 t -61.71 119.76 9.34 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.49 0.662 . . . . 0.0 109.422 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.4 OUTLIER -55.82 2.88 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.856 -0.528 . . . . 0.0 112.407 -178.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.512 ' HD3' " H4'" ' C' ' 232' ' ' ' DA' . 0.0 OUTLIER -113.35 -36.28 5.04 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 122.276 1.036 . . . . 0.0 109.272 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 27.5 m -89.53 -24.32 21.8 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -81.83 -42.68 1.05 Allowed Pre-proline 0 C--N 1.3 -1.586 0 O-C-N 121.399 -0.813 . . . . 0.0 112.247 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 48.8 Cg_endo -80.84 -31.4 1.42 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 122.874 0.933 . . . . 0.0 111.562 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.693 ' OD2' ' NH2' ' A' ' 39' ' ' ARG . 3.1 p-10 -74.89 178.23 5.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.989 -1.07 . . . . 0.0 110.342 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -109.16 131.9 54.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.258 -0.901 . . . . 0.0 111.823 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.789 ' HB1' ' C ' ' A' ' 24' ' ' ASP . . . -91.34 -116.24 0.08 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.998 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.8 m120 -57.12 -29.96 7.02 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 120.14 -1.6 . . . . 0.0 109.526 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.998 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 48.5 Cg_endo -57.81 -10.64 7.82 Favored 'Trans proline' 0 C--N 1.315 -1.218 0 N-CA-C 108.099 -1.539 . . . . 0.0 108.099 177.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.725 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -47.63 -60.48 2.52 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.73 0.776 . . . . 0.0 108.933 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -53.57 -34.79 59.57 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.53 -0.731 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 0.3 OUTLIER -69.35 -40.36 77.56 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.049 -1.032 . . . . 0.0 109.372 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.47 ' HD2' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -67.59 -26.56 66.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 108.607 178.194 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.966 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -29.82 52.14 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 118.367 -1.333 . . . . 0.0 107.777 178.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 1.5 m-20 -61.0 -37.69 83.39 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE2' ' HD2' ' A' ' 83' ' ' ARG . 2.8 tmmm? -58.91 -51.83 68.36 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 109.593 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.742 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 16.8 mm -53.02 -44.95 51.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.185 -0.947 . . . . 0.0 110.783 178.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.633 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 12.0 m -50.91 -45.57 60.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.375 -1.453 . . . . 0.0 107.701 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -54.86 -39.08 68.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.79 -36.72 65.22 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.633 ' HB3' ' O ' ' A' ' 88' ' ' THR . 1.1 t -62.58 -47.9 81.8 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.696 -1.202 . . . . 0.0 107.973 178.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 96' ' ' GLN . 4.5 ttt180 -49.88 -54.66 18.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.744 -0.597 . . . . 0.0 109.935 179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -36.95 68.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.379 -0.826 . . . . 0.0 110.708 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 132' ' ' GLN . 0.5 OUTLIER -69.19 -10.61 58.56 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-O 121.773 0.797 . . . . 0.0 110.185 -179.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 34.5 tp10 -130.46 -6.28 4.21 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -79.21 -45.41 19.92 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 121.509 -0.744 . . . . 0.0 109.661 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 5.3 pt-20 -84.83 -156.06 0.23 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 117.845 -1.542 . . . . 0.0 109.911 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.608 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.7 -61.28 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.157 -0.964 . . . . 0.0 109.433 178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.688 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 38.8 Cg_endo -65.05 141.65 71.02 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 N-CA-C 107.506 -1.767 . . . . 0.0 107.506 172.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 30.6 t -77.03 154.48 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 119.974 -1.704 . . . . 0.0 110.996 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.99 106.67 16.29 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.046 0.927 . . . . 0.0 112.106 -177.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.843 HD23 ' HB2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -131.24 -64.85 0.79 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 178.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -40.8 -45.17 2.4 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.137 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.39 -46.98 85.31 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.891 -1.131 . . . . 0.0 110.074 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 1.032 HD23 HD13 ' A' ' 116' ' ' LEU . 33.0 tp -69.25 -35.31 75.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.889 -1.132 . . . . 0.0 108.913 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.631 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -58.87 -53.6 56.54 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.582 0.706 . . . . 0.0 109.485 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.15 -30.05 71.28 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.623 -0.673 . . . . 0.0 110.638 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -71.48 -43.38 66.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.203 -0.936 . . . . 0.0 111.114 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.797 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 13.9 t -88.03 -6.88 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.908 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.797 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.8 28.44 0.31 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.446 -0.784 . . . . 0.0 110.058 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.745 ' CE ' HG11 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -139.9 167.14 22.81 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.75 -0.594 . . . . 0.0 109.544 179.015 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.08 170.39 13.94 Favored Pre-proline 0 N--CA 1.502 2.168 0 O-C-N 121.188 -0.945 . . . . 0.0 111.389 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.843 ' HB2' HD23 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.89 -35.84 53.53 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 O-C-N 123.671 1.353 . . . . 0.0 109.581 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 7.1 m-30 -69.59 -34.66 74.45 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.65 177.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.797 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 11.5 t-80 -70.25 -29.12 65.83 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 117.234 -1.787 . . . . 0.0 110.094 178.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.032 HD13 HD23 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -62.81 -41.19 99.19 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.416 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.824 ' NE2' HD21 ' A' ' 102' ' ' LEU . 27.1 m-70 -65.14 -41.67 94.54 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.61 ' HD3' ' O6 ' ' B' ' 202' ' ' ' DG' . 1.2 mmp_? -58.91 -36.5 74.82 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.522 -0.736 . . . . 0.0 109.593 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.753 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.2 OUTLIER -68.31 -50.38 53.9 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.273 -0.892 . . . . 0.0 109.274 177.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.722 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.27 0.4 OUTLIER -49.76 -40.06 39.9 Favored 'General case' 0 N--CA 1.512 2.674 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.004 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.666 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.1 OUTLIER -75.29 -38.56 60.32 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.864 -1.148 . . . . 0.0 110.308 178.052 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.26 -58.11 9.91 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.966 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.78 -60.24 2.53 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.138 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.828 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -48.78 -32.67 8.99 Favored 'General case' 0 N--CA 1.518 2.952 0 O-C-N 120.475 -1.391 . . . . 0.0 107.847 176.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.635 ' O ' ' HG2' ' A' ' 126' ' ' MET . . . 110.81 -40.32 2.59 Favored Glycine 0 N--CA 1.494 2.559 0 CA-C-O 118.092 -1.393 . . . . 0.0 114.372 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.635 ' HG2' ' O ' ' A' ' 125' ' ' GLY . 51.2 mmm -159.06 49.25 0.34 Allowed 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 122.803 3.301 . . . . 0.0 115.026 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.004 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.56 89.5 0.5 Allowed Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 120.098 -1.626 . . . . 0.0 111.023 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.666 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 55.5 Cg_endo -68.07 -109.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.491 1.336 0 O-C-N 122.546 0.761 . . . . 0.0 113.209 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.527 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -56.72 -26.1 56.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.943 -1.098 . . . . 0.0 110.968 -178.333 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.666 ' HB2' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.74 -42.26 77.82 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.329 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.004 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.78 -34.26 77.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.588 -1.32 . . . . 0.0 109.166 178.374 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -67.05 -42.23 85.16 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.214 -0.994 . . . . 0.0 108.879 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -66.82 -47.99 70.32 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.448 -0.782 . . . . 0.0 110.09 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.91 -58.61 7.13 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.252 -0.905 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.498 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -45.32 -48.6 13.16 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.937 0.875 . . . . 0.0 109.287 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.472 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 2.0 ttt180 -58.83 -36.58 74.78 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.368 0.604 . . . . 0.0 110.224 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.68 75.12 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.354 -0.841 . . . . 0.0 110.425 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -100.4 0.08 39.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.318 -0.864 . . . . 0.0 109.711 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 32.1 ttm-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.495 179.774 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.256 1 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.558 3 C3'-C2'-C1' 113.519 7.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.462 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.915 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.053 2 C3'-C2'-C1' 114.897 8.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.544 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.679 2 C3'-C2'-C1' 114.684 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.562 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.075 2 C3'-C2'-C1' 114.338 8.313 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.606 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.766 1 C3'-C2'-C1' 114.1 8.143 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.606 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.149 2 C3'-C2'-C1' 114.895 8.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.432 H2'' ' C8 ' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.933 2 C3'-C2'-C1' 114.654 8.539 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.59 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.729 1 C3'-C2'-C1' 115.036 8.811 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.59 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.943 2 C3'-C2'-C1' 114.603 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.797 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.614 1 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.657 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.758 1 C3'-C2'-C1' 114.626 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.56 ' C2 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.715 2 C3'-C2'-C1' 114.879 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.567 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 115.693 9.28 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.567 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.864 2 C3'-C2'-C1' 114.863 8.688 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.528 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.828 2 C3'-C2'-C1' 114.878 8.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.498 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.268 2 C3'-C2'-C1' 114.823 8.659 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.543 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.404 -11.383 2 C3'-C2'-C1' 114.455 8.397 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.69 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.308 2 C3'-C2'-C1' 114.607 8.505 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.69 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.139 1 C3'-C2'-C1' 114.725 8.589 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.667 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.612 1 C3'-C2'-C1' 114.827 8.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.538 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.581 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 114.547 8.462 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.581 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.958 1 C3'-C2'-C1' 115.267 8.976 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.697 2 C3'-C2'-C1' 114.708 8.577 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.413 -10.463 1 C3'-C2'-C1' 114.782 8.63 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.621 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.072 2 C3'-C2'-C1' 114.662 8.544 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.649 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.408 -11.027 2 C3'-C2'-C1' 114.731 8.594 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.236 2 C3'-C2'-C1' 114.916 8.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.635 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.401 -11.7 2 C3'-C2'-C1' 114.4 8.357 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.765 " C4'" ' HB3' ' A' ' 45' ' ' ARG . . . . . . . . 2 C3'--C2' 1.413 -10.511 2 C3'-C2'-C1' 114.832 8.666 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.704 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.334 2 C3'-C2'-C1' 115.593 9.209 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.485 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.81 8.65 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.411 -10.685 2 C3'-C2'-C1' 114.624 8.517 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.413 -10.47 2 C3'-C2'-C1' 114.277 8.269 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' A' ' 2' ' ' LYS . 20.5 mtt . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.06 0.457 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' CB ' ' O ' ' A' ' 1' ' ' MET . 20.3 tttm 68.72 -1.77 1.89 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 111.206 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp 46.57 57.8 5.16 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.089 -1.007 . . . . 0.0 111.338 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 7' ' ' LEU . . . -64.91 163.74 13.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.149 -0.969 . . . . 0.0 110.089 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 2.9 p -99.88 72.1 1.7 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.357 -0.84 . . . . 0.0 109.583 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 5' ' ' THR . 2.4 t 79.77 25.88 0.38 Allowed 'General case' 0 N--CA 1.499 2.011 0 CA-C-O 121.28 0.562 . . . . 0.0 109.54 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 4' ' ' ALA . 10.0 mt -110.09 -44.25 3.81 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.402 -0.811 . . . . 0.0 110.29 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.76 HG22 ' H ' ' A' ' 11' ' ' GLN . 62.8 m -81.62 63.51 5.93 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.827 -1.149 . . . . 0.0 108.107 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.555 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.8 p-10 -49.85 -26.62 4.19 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.85 -44.92 78.46 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.76 ' H ' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER -85.83 -33.57 21.29 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 117.387 -1.725 . . . . 0.0 110.037 178.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.654 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -51.13 -39.88 57.26 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 104.589 -2.374 . . . . 0.0 104.589 176.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.05 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 24.2 t-105 -66.57 -40.63 89.08 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.109 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 12.0 tt0 -58.57 -33.89 70.45 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 118.914 -1.114 . . . . 0.0 108.02 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.97 -34.03 66.21 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.748 ' HA ' ' CA ' ' A' ' 40' ' ' PRO . 96.4 t -70.5 -27.18 30.43 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 CA-C-O 122.313 1.054 . . . . 0.0 110.823 -179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.05 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.263 1.2 mt -94.71 -32.4 13.37 Favored 'General case' 0 C--N 1.266 -3.055 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 179.832 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 19' ' ' ARG . . . -75.22 -10.02 59.08 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.975 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.581 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 53.71 40.63 31.71 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.17 0.986 . . . . 0.0 109.842 -179.421 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.9 t0 -70.05 110.22 6.27 Favored Pre-proline 0 C--N 1.301 -1.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.522 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 43.7 Cg_endo -68.76 6.24 1.07 Allowed 'Trans proline' 0 C--N 1.307 -1.63 0 O-C-N 123.663 1.349 . . . . 0.0 109.699 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.297 1.2 t30 -102.76 -11.41 18.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 122.091 0.948 . . . . 0.0 108.897 -179.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -109.61 -5.85 15.55 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN 0.25 29.9 t0 -76.52 127.39 32.73 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.69 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -31.4 8.66 Favored Glycine 0 N--CA 1.505 3.273 0 N-CA-C 106.295 -2.722 . . . . 0.0 106.295 -176.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.7 tm-20 -77.96 -41.48 36.05 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.799 -0.824 . . . . 0.0 109.162 178.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.627 ' CZ ' HG23 ' A' ' 16' ' ' VAL . 1.9 p90 -152.28 170.48 19.94 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 110.186 178.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.27 175.78 9.17 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.257 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.79 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -137.74 120.01 15.75 Favored 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 118.114 -1.435 . . . . 0.0 109.071 176.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.56 ' HA ' ' O ' ' A' ' 36' ' ' ILE . . . -100.67 115.28 29.85 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.137 -176.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.049 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.61 102.27 12.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.28 0.3 OUTLIER -62.2 -20.15 63.88 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.997 0.903 . . . . 0.0 111.191 -178.827 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.049 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.87 -31.57 72.59 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.861 0.839 . . . . 0.0 108.857 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.711 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 11.2 t -119.27 1.97 11.33 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.065 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.33 34.8 89.55 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.957 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 57.2 mt -122.54 165.4 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.17 -1.194 . . . . 0.0 109.394 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.79 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.9 p90 -148.82 118.63 7.08 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 175.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.58 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.698 ' CZ ' ' OD1' ' A' ' 75' ' ' ASP 0.309 10.2 mtt85 -79.55 165.17 49.79 Favored Pre-proline 0 C--N 1.291 -1.955 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.748 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 38.3 Cg_endo -66.72 -15.04 46.22 Favored 'Trans proline' 0 C--N 1.291 -2.473 0 O-C-N 122.862 0.928 . . . . 0.0 109.959 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 7.1 p -115.25 30.65 7.21 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 51.6 t -49.91 135.91 19.16 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.753 -1.217 . . . . 0.0 110.355 179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.444 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.16 8.22 42.79 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.273 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.25 -50.96 5.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.639 -1.288 . . . . 0.0 112.579 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.594 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.12 175.8 0.15 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.858 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 6.3 m-70 -140.15 157.42 45.64 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.385 -1.447 . . . . 0.0 114.615 -178.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HA ' ' P ' ' C' ' 235' ' ' ' DT' . . . -120.1 153.2 36.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.561 -1.199 . . . . 0.0 109.061 177.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -50.79 157.27 0.82 Allowed 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.212 -0.93 . . . . 0.0 111.934 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.596 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.276 4.5 ttp-105 -60.28 -30.24 69.33 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 122.866 1.317 . . . . 0.0 108.647 178.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.27 1.4 tt0 -38.69 -64.18 0.46 Allowed 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.814 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 79.1 m-20 -89.95 17.3 6.95 Favored 'General case' 0 C--N 1.29 -2.005 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -114.77 129.27 71.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 O-C-N 121.65 -0.656 . . . . 0.0 111.468 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.769 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.5 p -123.56 175.06 7.02 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.602 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 80.7 m-85 -122.63 150.25 42.91 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.232 1.015 . . . . 0.0 111.536 -178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.773 ' HB2' HG22 ' A' ' 28' ' ' VAL . 46.7 m-85 -130.43 154.89 47.26 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.886 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.34 -39.93 77.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.1 p30 -139.72 165.86 26.16 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.396 1.093 . . . . 0.0 110.546 178.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.01 -24.14 67.6 Favored 'General case' 0 C--N 1.286 -2.17 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.207 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.604 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -71.27 -36.46 71.72 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.591 -1.318 . . . . 0.0 108.876 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 12.6 tp10 -62.18 -49.23 76.64 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.74 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.51 -43.92 89.29 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.745 HD21 ' HG3' ' A' ' 68' ' ' PRO . 59.2 mt -62.82 -28.88 70.31 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 59' ' ' SER . . . -80.05 -16.14 55.69 Favored 'General case' 0 C--N 1.31 -1.123 0 O-C-N 121.626 -0.671 . . . . 0.0 110.286 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . . . -78.56 0.35 26.56 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.149 -0.969 . . . . 0.0 110.318 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.03 36.94 10.48 Favored Glycine 0 C--N 1.286 -2.248 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.416 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.8 m-85 -112.28 158.73 19.38 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.27 -1.135 . . . . 0.0 111.319 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -99.84 117.7 63.05 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.745 ' HG3' HD21 ' A' ' 62' ' ' LEU . 35.6 Cg_endo -62.29 135.79 56.1 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.47 1.247 . . . . 0.0 110.326 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.612 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.8 t -55.32 115.76 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.606 0.717 . . . . 0.0 109.278 -178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -53.49 -5.56 0.06 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.557 -0.714 . . . . 0.0 111.659 -178.271 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.47 ' O ' ' HD2' ' A' ' 74' ' ' PRO . 8.6 tpt180 -103.94 -36.09 7.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 7.3 m -92.16 -5.65 52.21 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.051 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.684 ' N ' ' CD ' ' A' ' 74' ' ' PRO . 36.1 tp60 -93.95 -26.87 0.27 Allowed Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 112.074 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.684 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 54.8 Cg_endo -82.42 -53.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.664 0.823 . . . . 0.0 111.587 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.698 ' OD1' ' CZ ' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -74.98 178.39 5.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.912 -1.117 . . . . 0.0 110.804 -178.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.507 ' HB3' ' HG2' ' A' ' 79' ' ' PRO . 62.2 mmtt -109.16 140.75 42.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.368 -0.832 . . . . 0.0 113.049 -177.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.791 ' O ' ' HB2' ' A' ' 80' ' ' ARG . . . -79.52 -112.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.992 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 4.9 m120 -59.05 -30.5 7.84 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 119.59 -1.944 . . . . 0.0 108.24 175.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.992 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.7 Cg_endo -60.5 -14.1 28.8 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 N-CA-C 108.219 -1.493 . . . . 0.0 108.219 176.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.791 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -49.94 -60.67 2.71 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -51.93 -34.42 41.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.65 -0.657 . . . . 0.0 111.422 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' ASP . 4.3 m170 -69.07 -41.75 77.15 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.173 -0.954 . . . . 0.0 109.38 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -67.83 -25.45 65.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.939 -1.101 . . . . 0.0 109.059 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.0 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.56 -30.26 52.55 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' HIS . 5.1 m-20 -62.08 -37.73 86.16 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -58.12 -54.04 51.47 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.55 0.691 . . . . 0.0 109.775 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.775 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 15.5 mm -53.6 -43.81 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.011 -1.055 . . . . 0.0 110.972 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 96.3 m -52.92 -43.37 66.2 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.055 -1.653 . . . . 0.0 107.873 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -56.47 -37.64 70.61 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.775 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.72 -37.92 66.47 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.677 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.27 -54.76 36.09 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 118.84 -1.144 . . . . 0.0 109.223 178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 96' ' ' GLN . 29.1 ttt180 -45.77 -56.93 4.72 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.594 -0.691 . . . . 0.0 110.52 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.511 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 6.2 mt -56.35 -36.19 68.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.481 -0.762 . . . . 0.0 111.355 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.836 HD22 ' CD ' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.68 -10.42 56.13 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 121.525 0.679 . . . . 0.0 110.402 -178.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.49 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 14.0 tp10 -129.7 -11.89 4.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.672 -0.643 . . . . 0.0 109.492 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' ARG . 2.8 tm0? -79.4 -52.77 7.64 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 11.2 pt-20 -87.54 -155.65 0.3 Allowed 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.693 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.614 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.2 m -105.16 -61.42 0.05 OUTLIER Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 98' ' ' THR . 33.2 Cg_endo -60.35 137.74 76.45 Favored 'Trans proline' 0 C--N 1.297 -2.166 0 N-CA-C 103.452 -3.326 . . . . 0.0 103.452 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 94' ' ' LEU . 43.4 t -76.49 158.93 5.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -108.12 96.58 6.47 Favored 'General case' 0 C--N 1.295 -1.767 0 C-N-CA 115.631 -2.427 . . . . 0.0 108.548 -177.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' PRO . 6.9 mt -132.78 -53.94 0.93 Allowed 'General case' 0 C--N 1.271 -2.835 0 CA-C-N 111.386 -2.643 . . . . 0.0 104.173 175.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -40.66 -45.97 2.48 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.821 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.93 -39.55 72.61 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.59 -1.318 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.959 HD13 ' N ' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -74.98 -24.24 58.41 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.46 -0.775 . . . . 0.0 109.797 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.959 ' N ' HD13 ' A' ' 105' ' ' LEU . . . -77.14 -48.82 16.67 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.323 -0.861 . . . . 0.0 109.016 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -35.97 77.1 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.655 -0.653 . . . . 0.0 109.477 178.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -45.84 73.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.517 -0.74 . . . . 0.0 110.839 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 29.6 t -83.34 -13.21 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.74 27.18 0.35 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.498 -0.751 . . . . 0.0 110.313 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.668 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 16.6 ptp -138.18 164.42 29.22 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.376 -0.827 . . . . 0.0 111.348 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 170.82 12.28 Favored Pre-proline 0 N--CA 1.503 2.205 0 O-C-N 121.6 -0.688 . . . . 0.0 111.326 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.536 ' HB3' ' HB3' ' A' ' 102' ' ' LEU . 38.3 Cg_endo -63.22 -34.89 66.45 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.739 1.389 . . . . 0.0 110.37 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.607 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 9.0 m-30 -69.66 -38.16 76.99 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 118.365 -1.334 . . . . 0.0 109.232 177.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.895 ' NE2' " H2'" ' B' ' 201' ' ' ' DC' . 8.3 t-80 -70.55 -26.18 63.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 116.708 -1.997 . . . . 0.0 110.123 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.845 ' HB2' HD11 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.34 -46.35 90.61 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 175.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.535 ' N ' HD13 ' A' ' 116' ' ' LEU . 26.1 m170 -53.9 -44.87 70.89 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 115' ' ' HIS . 0.0 OUTLIER -56.01 -39.83 72.5 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.545 -0.722 . . . . 0.0 109.677 177.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.56 ' O ' HD23 ' A' ' 119' ' ' LEU . 1.3 tt -67.59 -51.34 51.55 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.221 -0.924 . . . . 0.0 109.378 178.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.771 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.26 0.3 OUTLIER -49.47 -40.0 35.58 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.072 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.755 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 8.4 tttt -76.2 -40.39 52.4 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.37 -54.32 48.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.537 -0.727 . . . . 0.0 109.168 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 1.0 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.02 -60.37 2.41 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 119.482 -0.887 . . . . 0.0 110.401 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.905 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.3 t -50.7 -32.47 19.5 Favored 'General case' 0 N--CA 1.516 2.863 0 O-C-N 120.551 -1.343 . . . . 0.0 108.04 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.506 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.15 -38.69 3.18 Favored Glycine 0 N--CA 1.493 2.494 0 CA-C-O 117.965 -1.464 . . . . 0.0 114.712 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.516 ' O ' ' OG1' ' A' ' 127' ' ' THR . 11.4 mtm -158.88 49.31 0.35 Allowed 'General case' 0 N--CA 1.514 2.745 0 CA-C-N 123.163 3.482 . . . . 0.0 115.586 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.909 ' O ' ' HB2' ' A' ' 131' ' ' TRP . 1.3 m -170.74 91.59 0.47 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 120.114 -1.616 . . . . 0.0 111.059 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.755 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -69.69 -104.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 122.544 0.76 . . . . 0.0 113.176 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.658 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -60.07 -24.31 64.48 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.575 -1.328 . . . . 0.0 110.773 -178.269 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.722 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.37 -39.22 81.85 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 119.132 -1.027 . . . . 0.0 109.424 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.909 ' HB2' ' O ' ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.66 -36.09 83.15 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.621 -1.299 . . . . 0.0 108.546 177.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.836 ' CD ' HD22 ' A' ' 94' ' ' LEU . 20.7 tp60 -61.94 -54.03 47.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.599 -0.688 . . . . 0.0 109.671 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -47.51 82.66 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.557 -0.714 . . . . 0.0 111.122 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.75 -59.93 4.05 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.25 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.478 ' CZ2' ' CE2' ' A' ' 131' ' ' TRP . 0.0 OUTLIER -47.55 -48.33 27.77 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.913 0.863 . . . . 0.0 109.11 178.677 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.49 ' HG3' ' HG2' ' A' ' 95' ' ' GLU . 13.4 ttt180 -56.75 -40.08 75.15 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.293 0.568 . . . . 0.0 110.132 178.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.37 80.82 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.582 -0.699 . . . . 0.0 110.58 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 13.9 ttm-85 -100.15 -3.59 31.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 135' ' ' TRP . 1.2 ttm180 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.157 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.492 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.212 1 C3'-C2'-C1' 114.761 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.492 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.402 -11.635 3 C3'-C2'-C1' 113.641 7.815 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.457 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.88 1 C3'-C2'-C1' 114.919 8.728 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.228 2 C3'-C2'-C1' 114.995 8.782 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.505 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.407 -11.062 2 C3'-C2'-C1' 114.809 8.649 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.598 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.419 -9.938 2 C3'-C2'-C1' 114.111 8.15 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.611 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.41 -10.835 2 C3'-C2'-C1' 114.168 8.192 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.611 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.025 2 C3'-C2'-C1' 114.818 8.656 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.444 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.42 -9.833 2 C3'-C2'-C1' 114.687 8.562 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.59 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.412 -10.594 1 C3'-C2'-C1' 115.236 8.954 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.59 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.948 2 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.895 " H2'" ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.411 -10.723 1 C3'-C2'-C1' 114.582 8.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.658 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.789 1 C3'-C2'-C1' 114.551 8.465 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.573 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.41 -10.767 2 C3'-C2'-C1' 114.477 8.412 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.415 -10.266 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 114.943 8.745 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.52 H2'' " O5'" ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.791 2 C3'-C2'-C1' 114.764 8.617 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.141 2 C3'-C2'-C1' 114.712 8.58 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.405 -11.27 2 C3'-C2'-C1' 114.149 8.178 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.633 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.327 2 C3'-C2'-C1' 114.538 8.456 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.633 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.156 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.886 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.414 1 C3'-C2'-C1' 114.878 8.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.47 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.038 1 C3'-C2'-C1' 114.958 8.756 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.47 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.416 -10.226 2 C3'-C2'-C1' 114.519 8.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.541 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.065 1 C3'-C2'-C1' 115.249 8.963 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.541 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.629 2 C3'-C2'-C1' 114.629 8.521 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.461 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.339 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.593 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.146 2 C3'-C2'-C1' 114.802 8.645 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.619 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.784 2 C3'-C2'-C1' 114.9 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.619 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.408 2 C3'-C2'-C1' 115.058 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.612 ' OP1' ' HA ' ' A' ' 69' ' ' CYS . . . . . . . . 2 C3'--C2' 1.406 -11.211 1 C3'-C2'-C1' 114.566 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.957 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.412 -10.594 2 C3'-C2'-C1' 114.906 8.719 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.832 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.41 -10.762 2 C3'-C2'-C1' 115.483 9.131 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.493 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.246 2 C3'-C2'-C1' 114.789 8.635 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.44 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.41 -10.77 2 C3'-C2'-C1' 114.504 8.431 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.44 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.444 2 C3'-C2'-C1' 114.273 8.266 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 ttp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.212 0.53 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -106.06 150.81 25.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -169.32 156.05 6.68 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.428 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -129.13 -154.37 0.63 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 5' ' ' THR . 10.1 t -62.19 46.8 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.349 -0.844 . . . . 0.0 110.357 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.692 ' N ' ' O ' ' A' ' 4' ' ' ALA . 35.1 m 79.62 107.16 0.07 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.92 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.665 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 6.1 mt 93.81 75.83 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 CA-C-O 121.837 0.827 . . . . 0.0 113.161 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.601 ' C ' ' HD2' ' A' ' 12' ' ' ARG . 21.2 m -97.16 64.26 1.93 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 175.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.564 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.2 p-10 -39.51 -28.17 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 8' ' ' THR . 18.0 m-20 -55.13 -51.57 66.04 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.258 -0.901 . . . . 0.0 109.803 178.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 14' ' ' GLN . 0.9 OUTLIER -83.78 -32.33 25.45 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 117.142 -1.823 . . . . 0.0 110.313 179.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 1.038 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -50.34 -40.82 50.24 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 177.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.054 ' NE1' HD11 ' A' ' 17' ' ' LEU . 14.9 t-105 -65.83 -40.57 91.92 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.843 -1.143 . . . . 0.0 108.617 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -63.18 -29.96 71.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 118.839 -1.144 . . . . 0.0 108.33 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 40' ' ' PRO . 19.6 m -74.08 -26.81 60.59 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.854 0.835 . . . . 0.0 108.872 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.038 HG23 ' O ' ' A' ' 12' ' ' ARG . 42.5 t -78.6 -38.25 21.85 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-O 122.337 1.065 . . . . 0.0 111.997 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.054 HD11 ' NE1' ' A' ' 13' ' ' TRP 0.265 5.1 mt -81.27 -32.99 33.01 Favored 'General case' 0 C--N 1.262 -3.228 0 CA-C-O 122.334 1.064 . . . . 0.0 109.157 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.714 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -73.81 -35.61 64.89 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.419 -178.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 1.6 ptm180 95.15 29.8 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -61.81 110.09 2.86 Favored Pre-proline 0 C--N 1.304 -1.407 0 O-C-N 121.795 -0.565 . . . . 0.0 110.378 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 49.5 Cg_endo -74.75 6.24 3.4 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.839 1.441 . . . . 0.0 109.489 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.477 ' C ' HD21 ' A' ' 78' ' ' ASN 0.3 1.2 t30 -101.73 -11.14 19.36 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.88 0.848 . . . . 0.0 109.248 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.908 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -106.46 -5.96 18.51 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.406 -0.917 . . . . 0.0 108.953 177.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.856 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 9.9 t0 -76.99 126.04 30.31 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.666 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 101.06 -33.19 6.65 Favored Glycine 0 N--CA 1.507 3.423 0 N-CA-C 106.644 -2.583 . . . . 0.0 106.644 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' O ' ' A' ' 56' ' ' ALA . 2.0 tt0 -79.25 -42.96 24.71 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.627 -0.925 . . . . 0.0 109.27 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.908 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.3 p90 -150.46 170.55 18.81 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.338 1.066 . . . . 0.0 110.978 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.779 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.5 175.65 9.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.089 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.778 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -139.12 119.71 14.04 Favored 'General case' 0 C--N 1.282 -2.366 0 C-N-CA 117.884 -1.526 . . . . 0.0 108.868 176.125 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.5 112.88 24.54 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.532 -1.213 . . . . 0.0 113.148 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.064 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -88.35 102.81 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.275 18.6 mtt85 -63.22 -20.04 65.07 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.94 0.876 . . . . 0.0 111.272 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.064 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -66.39 -32.25 73.51 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.741 0.782 . . . . 0.0 109.218 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.616 HG22 ' HB ' ' A' ' 31' ' ' VAL . 10.0 t -117.8 3.43 12.26 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.334 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.88 35.89 91.09 Favored Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.909 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 58.3 mt -125.2 166.26 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.147 -1.207 . . . . 0.0 109.504 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 3.2 p90 -148.96 115.76 5.98 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.532 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.656 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 4.7 mtp180 -93.94 178.35 1.59 Allowed Pre-proline 0 C--N 1.287 -2.143 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.786 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 41.2 Cg_endo -67.23 -21.49 48.02 Favored 'Trans proline' 0 C--N 1.291 -2.466 0 O-C-N 123.433 1.228 . . . . 0.0 111.531 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 28.4 p -115.26 30.84 7.09 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.718 -1.239 . . . . 0.0 113.055 -177.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 54.1 t -45.31 136.53 5.25 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.648 -1.282 . . . . 0.0 109.824 179.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.542 ' HD3' ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -100.91 5.73 43.39 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.036 -179.2 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -90.15 -50.86 5.75 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.737 -1.227 . . . . 0.0 111.91 -178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.699 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 169.99 172.88 0.06 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 1.051 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 4.0 m-70 -128.61 159.4 35.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.281 -1.512 . . . . 0.0 114.463 -178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.865 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -119.94 162.69 18.76 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.709 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.2 mt -53.22 159.5 1.3 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.121 -0.987 . . . . 0.0 112.681 -177.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.633 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.275 14.2 ttm180 -70.89 -30.47 66.84 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.973 1.368 . . . . 0.0 108.993 178.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.282 0.8 OUTLIER -39.55 -61.57 0.79 Allowed 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.074 -1.421 . . . . 0.0 111.842 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.733 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.0 m-20 -89.9 17.24 6.95 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.192 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.809 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -110.95 124.25 67.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.087 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.878 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.778 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.91 175.21 6.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 82.7 m-85 -120.94 150.28 41.33 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.021 -1.05 . . . . 0.0 111.739 -178.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.779 ' HB2' HG22 ' A' ' 28' ' ' VAL . 49.4 m-85 -131.06 155.43 46.9 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.831 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -70.53 -39.93 73.75 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.31 166.27 24.98 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 122.411 1.101 . . . . 0.0 110.479 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.704 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.14 -24.67 68.0 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.131 178.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.656 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.24 -36.48 71.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.665 -1.272 . . . . 0.0 108.986 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 11.6 tp10 -61.23 -48.34 81.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 177.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.729 ' HB2' HG21 ' A' ' 28' ' ' VAL . . . -59.19 -45.82 90.05 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 66.0 mt -59.89 -27.42 66.71 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -79.13 -18.6 52.92 Favored 'General case' 0 C--N 1.312 -1.054 0 O-C-N 121.59 -0.694 . . . . 0.0 110.236 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -77.65 0.41 23.39 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.236 -0.915 . . . . 0.0 110.521 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.54 36.74 13.32 Favored Glycine 0 C--N 1.284 -2.321 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 27.3 m-85 -111.33 165.59 11.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.268 -1.137 . . . . 0.0 111.79 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -103.3 116.04 62.85 Favored Pre-proline 0 C--N 1.3 -1.561 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.703 ' HG3' HD21 ' A' ' 62' ' ' LEU . 33.2 Cg_endo -61.25 136.31 63.61 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.528 1.278 . . . . 0.0 110.863 -178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.583 ' SG ' H5'' ' C' ' 233' ' ' ' DA' . 3.5 t -59.5 119.71 8.02 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' OP1' ' C' ' 232' ' ' ' DA' . 2.4 tptt -56.68 0.51 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.638 -0.664 . . . . 0.0 111.716 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.542 ' HG3' ' HD3' ' A' ' 43' ' ' ARG 0.254 0.5 OUTLIER -110.24 -36.27 5.86 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.199 0.999 . . . . 0.0 108.669 -179.695 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.3 m -91.24 -14.03 31.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.04 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.668 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -88.05 -49.08 0.44 Allowed Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.22 -0.925 . . . . 0.0 110.998 -178.735 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 52.8 Cg_endo -81.29 -4.42 12.46 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.06 1.032 . . . . 0.0 111.887 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.656 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 36.6 p-10 -93.33 178.22 5.79 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.775 -1.203 . . . . 0.0 110.82 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.422 ' O ' ' NH2' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -98.09 134.4 41.22 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.347 -0.845 . . . . 0.0 111.492 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.733 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -103.81 -134.96 0.33 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.618 -0.676 . . . . 0.0 109.46 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.035 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.2 m120 -55.71 -30.51 7.57 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 120.062 -1.649 . . . . 0.0 109.203 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.035 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 45.6 Cg_endo -57.89 -10.33 7.45 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 N-CA-C 107.045 -1.944 . . . . 0.0 107.045 175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 64.3 ttp85 -42.81 -66.57 0.35 Allowed 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.706 0.765 . . . . 0.0 108.983 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -49.52 -36.33 22.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.851 -0.531 . . . . 0.0 111.849 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -69.53 -42.28 74.84 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.04 -1.037 . . . . 0.0 110.093 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -67.49 -28.7 68.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.114 -0.991 . . . . 0.0 109.198 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.92 HD21 ' C ' ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.86 -29.7 50.57 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 118.214 -1.394 . . . . 0.0 108.089 179.081 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.26 -37.93 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.953 -1.092 . . . . 0.0 108.062 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -52.14 66.92 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 121.761 0.791 . . . . 0.0 109.45 177.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.766 HG22 ' CZ ' ' A' ' 120' ' ' PHE . 29.6 mm -51.29 -45.1 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 O-C-N 121.231 -0.918 . . . . 0.0 111.046 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 19.7 m -51.13 -45.29 61.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.404 -1.435 . . . . 0.0 107.912 178.121 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -55.32 -39.02 69.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD21 ' A' ' 93' ' ' LEU . . . -54.69 -37.46 65.81 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.655 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.47 -58.08 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.202 178.794 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.69 -61.73 1.32 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.686 -0.633 . . . . 0.0 110.524 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -55.38 -35.56 65.43 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.466 -0.771 . . . . 0.0 112.3 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.803 HD22 ' NE2' ' A' ' 132' ' ' GLN . 0.1 OUTLIER -68.64 -10.68 57.61 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.234 -0.917 . . . . 0.0 110.897 -177.798 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.447 ' HG2' ' HG3' ' A' ' 136' ' ' ARG . 9.1 tp10 -135.24 -8.75 2.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.194 -0.941 . . . . 0.0 110.187 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -89.97 -43.45 10.54 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.16 -0.963 . . . . 0.0 110.385 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.699 ' OE2' ' OG1' ' A' ' 101' ' ' THR . 6.5 pt-20 -87.34 -155.34 0.28 Allowed 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 118.847 -1.141 . . . . 0.0 110.579 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 13.5 m -103.76 -60.95 0.06 OUTLIER Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.631 -0.668 . . . . 0.0 109.886 179.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' A' ' 98' ' ' THR . 41.7 Cg_endo -67.68 140.31 51.08 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 N-CA-C 107.2 -1.884 . . . . 0.0 107.2 179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 t -77.74 143.54 12.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.699 ' OG1' ' OE2' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -108.89 97.69 7.29 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 116.433 -2.107 . . . . 0.0 110.928 -177.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -132.7 -42.18 0.93 Allowed 'General case' 0 C--N 1.275 -2.647 0 CA-C-N 112.477 -2.147 . . . . 0.0 105.594 176.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -39.47 -46.04 1.63 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.979 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -44.55 87.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.452 -1.405 . . . . 0.0 109.303 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.498 HD22 HD21 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -73.13 -27.03 61.44 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 109.69 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -68.58 -50.46 51.58 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.449 -0.782 . . . . 0.0 109.945 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.45 -35.35 79.04 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.662 -0.649 . . . . 0.0 110.604 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.22 -55.23 23.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.243 -0.911 . . . . 0.0 110.909 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.765 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 15.8 t -76.16 -18.1 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.16 -0.963 . . . . 0.0 110.731 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.99 33.88 0.17 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -135.46 164.55 27.52 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.211 -0.931 . . . . 0.0 110.279 179.044 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 113' ' ' PRO . 0.7 OUTLIER -73.03 170.66 12.8 Favored Pre-proline 0 N--CA 1.5 2.038 0 O-C-N 121.56 -0.713 . . . . 0.0 110.992 -179.466 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.476 ' CB ' ' HG ' ' A' ' 102' ' ' LEU . 38.0 Cg_endo -64.27 -29.03 63.96 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.775 1.408 . . . . 0.0 109.566 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.706 ' CZ ' ' H73' ' C' ' 223' ' ' ' DT' . 5.6 m-30 -69.74 -39.46 76.75 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 118.662 -1.215 . . . . 0.0 108.728 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.8 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 9.3 t-80 -70.46 -28.02 64.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 117.138 -1.825 . . . . 0.0 110.603 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 102' ' ' LEU . 2.9 tm? -63.45 -41.47 98.64 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' A' ' 128' ' ' PRO . 30.1 m170 -61.28 -43.14 99.37 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.457 ' CD ' ' O6 ' ' B' ' 202' ' ' ' DG' . 0.0 OUTLIER -57.7 -36.28 71.75 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 109.831 177.779 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 119' ' ' LEU . 0.5 OUTLIER -68.92 -47.54 65.51 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.122 -0.986 . . . . 0.0 108.913 177.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.766 ' CZ ' HG22 ' A' ' 87' ' ' ILE 0.284 0.3 OUTLIER -49.69 -40.18 39.22 Favored 'General case' 0 N--CA 1.515 2.794 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.401 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 0.2 OUTLIER -76.81 -37.94 54.84 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.838 -1.163 . . . . 0.0 110.191 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.64 -57.2 14.05 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.92 ' C ' HD21 ' A' ' 84' ' ' LEU . 1.4 m -68.81 -60.29 2.49 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.374 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.89 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.1 t -48.2 -32.04 6.57 Favored 'General case' 0 N--CA 1.519 2.998 0 O-C-N 120.646 -1.284 . . . . 0.0 107.87 176.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.55 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 111.43 -40.06 2.67 Favored Glycine 0 N--CA 1.494 2.506 0 CA-C-O 117.866 -1.519 . . . . 0.0 114.414 179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.55 ' CG ' ' O ' ' A' ' 125' ' ' GLY . 13.1 mtp -161.05 48.81 0.22 Allowed 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 123.179 3.49 . . . . 0.0 115.449 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.918 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -170.94 92.7 0.45 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.022 -1.674 . . . . 0.0 111.25 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.756 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 47.1 Cg_endo -66.95 -110.51 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 122.379 0.673 . . . . 0.0 112.839 -179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.65 ' HB3' ' P ' ' C' ' 224' ' ' ' DT' . 0.1 OUTLIER -59.99 -21.69 61.59 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.74 -1.225 . . . . 0.0 111.136 -178.436 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.669 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.57 -41.91 79.03 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.918 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.74 -35.74 82.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.692 -1.255 . . . . 0.0 108.573 177.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.803 ' NE2' HD22 ' A' ' 94' ' ' LEU . 5.2 tt0 -58.64 -45.67 88.76 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.86 -43.63 83.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.815 . . . . 0.0 110.355 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.4 -57.38 12.89 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.948 -1.095 . . . . 0.0 109.427 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -47.06 -48.76 22.31 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.174 0.988 . . . . 0.0 109.252 178.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.475 ' N ' ' SG ' ' A' ' 91' ' ' CYS . 14.7 ttm180 -58.31 -39.05 78.34 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.468 0.652 . . . . 0.0 110.272 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -67.93 -33.94 75.65 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.484 -0.76 . . . . 0.0 110.913 -178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -100.38 -10.52 21.12 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.255 -0.903 . . . . 0.0 110.078 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' TRP . 14.0 ttm105 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.252 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.529 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.327 1 C3'-C2'-C1' 114.702 8.573 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.529 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.403 -11.548 2 C3'-C2'-C1' 113.542 7.744 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.501 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.881 1 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.533 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.216 2 C3'-C2'-C1' 115.057 8.827 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.533 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.855 2 C3'-C2'-C1' 114.664 8.546 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.554 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -10.039 2 C3'-C2'-C1' 114.268 8.263 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.601 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.906 1 C3'-C2'-C1' 114.128 8.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.601 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 114.821 8.658 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.459 " O5'" H2'' ' B' ' 197' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.891 2 C3'-C2'-C1' 114.773 8.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.587 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.722 1 C3'-C2'-C1' 115.192 8.923 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.587 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.659 1 C3'-C2'-C1' 114.652 8.537 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.8 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 3 C3'--C2' 1.412 -10.624 1 C3'-C2'-C1' 114.649 8.535 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.656 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.408 -11.048 1 C3'-C2'-C1' 114.683 8.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.644 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.337 2 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.538 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.191 2 C3'-C2'-C1' 115.827 9.376 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.412 -10.636 2 C3'-C2'-C1' 114.748 8.606 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.524 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.92 2 C3'-C2'-C1' 114.726 8.59 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.506 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.335 2 C3'-C2'-C1' 114.762 8.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.518 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.405 -11.303 2 C3'-C2'-C1' 114.379 8.342 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.682 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.434 2 C3'-C2'-C1' 114.602 8.502 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.706 ' H73' ' CZ ' ' A' ' 114' ' ' PHE . . . . . . . . 2 C3'--C2' 1.419 -9.857 1 C3'-C2'-C1' 114.825 8.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.714 ' OP2' ' H71' ' C' ' 224' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.4 1 C3'-C2'-C1' 114.817 8.655 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.491 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 115.062 8.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.491 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.418 -9.991 1 C3'-C2'-C1' 114.573 8.481 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.504 H2'' " O5'" ' C' ' 228' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.416 -10.203 1 C3'-C2'-C1' 115.151 8.893 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.701 2 C3'-C2'-C1' 114.7 8.571 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.49 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.409 1 C3'-C2'-C1' 114.771 8.622 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.555 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.994 1 C3'-C2'-C1' 114.736 8.597 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.631 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.936 2 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.631 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.34 2 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.606 " H3'" HD13 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.404 -11.426 1 C3'-C2'-C1' 114.575 8.482 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 1.051 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.411 -10.711 2 C3'-C2'-C1' 114.859 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.83 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.693 2 C3'-C2'-C1' 115.497 9.141 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.499 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.372 2 C3'-C2'-C1' 114.753 8.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.407 H2'' " O5'" ' C' ' 238' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.411 -10.719 2 C3'-C2'-C1' 114.525 8.446 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . 0.407 " O5'" H2'' ' C' ' 237' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.414 -10.363 2 C3'-C2'-C1' 114.312 8.294 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.228 0.537 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -151.6 -57.75 0.15 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.325 -0.86 . . . . 0.0 110.148 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 26.5 mtmt 56.48 166.4 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.521 -0.737 . . . . 0.0 110.547 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' CYS . . . -112.92 -154.67 0.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.133 -0.979 . . . . 0.0 108.513 179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.554 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 6.5 m -66.8 48.28 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.201 -0.937 . . . . 0.0 110.037 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.554 ' CB ' ' O ' ' A' ' 5' ' ' THR . 1.3 t 79.51 40.15 0.09 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.749 -0.594 . . . . 0.0 109.589 -179.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 168.19 75.93 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.678 0.752 . . . . 0.0 110.819 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 11' ' ' GLN . 21.3 m -80.03 63.56 4.58 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.489 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 2.0 p30 -45.31 -30.61 1.32 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.7 -48.13 80.43 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.644 ' H ' HG22 ' A' ' 8' ' ' THR . 0.7 OUTLIER -79.58 -27.87 41.12 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 117.479 -1.688 . . . . 0.0 108.972 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.819 ' O ' HG23 ' A' ' 16' ' ' VAL . 22.4 mmt180 -53.47 -43.03 67.83 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 105.125 -2.176 . . . . 0.0 105.125 176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.029 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 28.2 t-105 -61.07 -40.71 94.7 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.546 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -60.21 -33.05 71.72 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -70.75 -33.86 71.25 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 122.158 0.98 . . . . 0.0 108.539 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 12' ' ' ARG . 48.5 t -71.3 -35.41 57.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.494 1.14 . . . . 0.0 111.475 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.029 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.257 2.0 mt -88.97 -31.28 18.22 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 122.15 0.976 . . . . 0.0 109.057 -179.475 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.546 ' CB ' ' O ' ' A' ' 14' ' ' GLN . . . -79.01 -12.5 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.35 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 49.9 mtm-85 65.7 39.08 4.99 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.212 -0.93 . . . . 0.0 109.424 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 22' ' ' ASN . 32.9 t0 -70.13 110.05 5.99 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.787 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 19' ' ' ARG . 44.0 Cg_endo -71.05 6.51 1.71 Allowed 'Trans proline' 0 C--N 1.309 -1.507 0 O-C-N 123.689 1.362 . . . . 0.0 109.447 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 20' ' ' ASP 0.299 1.2 t30 -102.01 -11.5 18.87 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.953 0.882 . . . . 0.0 109.26 -178.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.773 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -109.39 -5.84 15.67 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.84 ' O ' ' CG ' ' A' ' 78' ' ' ASN . 29.8 t0 -79.89 127.51 32.33 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.777 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.86 -24.57 31.53 Favored Glycine 0 N--CA 1.507 3.379 0 N-CA-C 106.383 -2.687 . . . . 0.0 106.383 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 56' ' ' ALA . 8.0 tp10 -89.88 -43.14 10.81 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 121.857 -0.79 . . . . 0.0 109.285 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 8.3 p90 -150.25 170.49 18.87 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 122.318 1.056 . . . . 0.0 111.174 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.78 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.1 m -128.86 175.53 10.11 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 178.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.793 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.4 OUTLIER -138.15 120.64 16.07 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 118.089 -1.444 . . . . 0.0 109.222 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -99.66 114.19 27.12 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.078 -176.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.015 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.05 104.93 14.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . 0.279 79.1 mtm-85 -65.12 -20.12 66.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.879 0.847 . . . . 0.0 111.244 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.015 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -65.22 -30.33 71.21 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 121.911 0.862 . . . . 0.0 109.135 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.646 HG22 ' HB ' ' A' ' 31' ' ' VAL . 11.2 t -119.43 -5.38 10.34 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.292 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . 68.96 31.94 72.97 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.894 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 64.8 mt -120.13 165.48 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.224 -1.163 . . . . 0.0 109.115 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' PHE . 2.6 p90 -148.46 118.1 7.04 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.56 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' NH1' ' OD1' ' A' ' 75' ' ' ASP 0.281 14.5 mtm180 -84.43 170.08 14.83 Favored Pre-proline 0 C--N 1.287 -2.13 0 N-CA-C 105.566 -2.013 . . . . 0.0 105.566 177.441 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.708 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 39.0 Cg_endo -67.96 -12.46 35.33 Favored 'Trans proline' 0 C--N 1.291 -2.485 0 O-C-N 122.843 0.917 . . . . 0.0 110.664 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 46.5 p -115.4 30.65 7.22 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.759 -1.213 . . . . 0.0 112.834 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 44.0 t -54.56 133.89 46.39 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.538 -1.351 . . . . 0.0 109.844 178.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.525 ' O ' " H4'" ' B' ' 198' ' ' ' DA' . 0.0 OUTLIER -101.39 7.87 42.47 Favored 'General case' 0 C--N 1.286 -2.178 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -88.0 -50.81 6.18 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.408 -1.433 . . . . 0.0 112.671 -177.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 174.82 175.25 0.19 Allowed 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.812 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.9 m-70 -140.18 159.59 41.85 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.27 -1.519 . . . . 0.0 114.025 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.653 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 158.0 27.94 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.645 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.69 156.02 1.49 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.01 -1.056 . . . . 0.0 112.271 -178.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.616 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.28 0.0 OUTLIER -61.34 -30.28 70.42 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.996 1.379 . . . . 0.0 108.645 178.713 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.28 0.7 OUTLIER -39.63 -62.12 0.73 Allowed 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 113.952 -1.476 . . . . 0.0 112.142 -179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.786 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 76.8 m-20 -90.53 17.24 7.66 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.679 HG22 HG22 ' A' ' 31' ' ' VAL . 2.1 t -112.67 126.26 70.04 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 121.609 -0.682 . . . . 0.0 111.063 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.793 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.3 p -121.25 175.24 6.23 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 76.9 m-85 -121.25 150.33 41.52 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 122.227 1.013 . . . . 0.0 111.673 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.78 ' HB2' HG22 ' A' ' 28' ' ' VAL . 50.0 m-85 -131.81 154.94 48.61 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.663 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . -69.55 -40.0 77.1 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.539 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.8 p30 -139.55 165.61 26.79 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.497 1.142 . . . . 0.0 110.539 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.724 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -63.45 -24.5 67.86 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.059 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.679 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.8 t -71.39 -35.93 71.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.678 -1.264 . . . . 0.0 109.211 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.0 tp10 -62.33 -48.64 78.94 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 177.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -59.07 -44.96 91.91 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' ALA . 69.0 mt -59.78 -28.61 67.57 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -78.16 -18.41 55.6 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.743 -0.598 . . . . 0.0 110.209 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -78.19 0.39 25.22 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.968 0.89 . . . . 0.0 110.408 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.58 36.66 13.49 Favored Glycine 0 C--N 1.285 -2.294 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 35' ' ' GLY . 17.6 m-85 -110.48 160.89 16.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.262 -1.14 . . . . 0.0 111.673 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -99.97 116.02 65.01 Favored Pre-proline 0 C--N 1.302 -1.487 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.714 ' HG3' HD21 ' A' ' 62' ' ' LEU . 34.3 Cg_endo -62.47 136.48 59.25 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 O-C-N 123.505 1.266 . . . . 0.0 110.64 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.58 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 1.8 t -57.36 121.13 9.47 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.509 0.671 . . . . 0.0 109.772 -178.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 74' ' ' PRO . 1.5 ttmt -54.58 -1.67 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.723 -0.611 . . . . 0.0 112.201 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' CYS . 0.0 OUTLIER -110.15 -35.55 6.07 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 109.538 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 23.4 m -90.15 -21.22 22.33 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.691 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -79.91 -38.11 1.16 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.383 -0.823 . . . . 0.0 112.18 -178.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 73' ' ' GLN . 50.2 Cg_endo -77.86 -41.52 0.31 Allowed 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 122.853 0.922 . . . . 0.0 112.159 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.684 ' OD1' ' NH1' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -74.86 178.1 5.77 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.808 -1.183 . . . . 0.0 110.657 -178.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HD3' ' HB2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -107.31 140.09 40.76 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.359 -0.838 . . . . 0.0 111.811 -178.126 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.777 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -87.02 -112.55 0.05 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.625 -0.672 . . . . 0.0 109.194 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.017 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -59.42 -30.61 7.85 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 119.62 -1.925 . . . . 0.0 108.506 176.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.017 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 57.1 Cg_endo -60.7 -14.9 34.06 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 N-CA-C 107.729 -1.681 . . . . 0.0 107.729 176.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 15.0 tpt180 -49.69 -64.51 0.79 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -50.0 -34.55 21.49 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.601 -0.687 . . . . 0.0 111.791 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -69.12 -42.22 76.33 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.032 -1.043 . . . . 0.0 109.218 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 27.7 tpt85 -67.82 -23.77 65.22 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.101 -0.999 . . . . 0.0 108.913 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.917 HD22 HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER -77.6 -32.86 53.82 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.02 -37.58 85.44 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.756 -0.59 . . . . 0.0 110.269 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.776 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -60.69 -38.2 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.843 -1.161 . . . . 0.0 110.477 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.765 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 46.5 m -53.82 -43.78 69.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.055 -1.653 . . . . 0.0 107.332 176.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -56.21 -38.61 71.26 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 87' ' ' ILE . . . -54.92 -34.61 63.33 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 177.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.765 ' HB3' ' O ' ' A' ' 88' ' ' THR . 0.1 OUTLIER -62.15 -50.21 72.77 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.607 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 tpt180 -48.46 -52.38 22.51 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.731 179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.54 ' HB3' ' OG1' ' A' ' 101' ' ' THR . 2.3 mm? -56.34 -36.9 69.28 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.641 -0.662 . . . . 0.0 111.325 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -69.33 -10.38 57.61 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 121.35 0.595 . . . . 0.0 110.613 -178.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.539 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 0.6 OUTLIER -129.53 -2.92 4.85 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 178.62 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 92' ' ' ARG . 9.6 tp60 -85.27 -57.21 3.17 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.347 -0.845 . . . . 0.0 109.551 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 99' ' ' PRO . 17.7 pt-20 -87.54 -155.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 118.656 -1.217 . . . . 0.0 110.58 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.677 ' H ' ' HD2' ' A' ' 99' ' ' PRO . 2.0 m -105.02 -60.84 0.05 OUTLIER Pre-proline 0 N--CA 1.494 1.768 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.677 ' HD2' ' H ' ' A' ' 98' ' ' THR . 39.0 Cg_endo -65.35 141.93 70.42 Favored 'Trans proline' 0 C--N 1.314 -1.271 0 N-CA-C 107.449 -1.789 . . . . 0.0 107.449 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.73 HG13 ' HG ' ' A' ' 94' ' ' LEU . 35.7 t -76.79 151.21 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.293 -1.505 . . . . 0.0 109.545 -177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -109.57 99.18 8.42 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 123.291 1.519 . . . . 0.0 111.631 -177.691 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.725 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -131.26 -24.92 2.26 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.446 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -38.58 -45.07 1.03 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.162 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.76 81.15 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 118.297 -1.361 . . . . 0.0 109.497 -178.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.822 ' HG ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -69.58 -53.37 19.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.299 -0.876 . . . . 0.0 109.615 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -52.61 -41.68 63.9 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.327 -0.858 . . . . 0.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 1.3 m-20 -67.92 -37.17 81.34 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.384 -0.823 . . . . 0.0 110.654 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -71.4 -34.15 70.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.216 -0.928 . . . . 0.0 111.295 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.783 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 24.5 t -95.06 -16.85 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.035 -1.041 . . . . 0.0 111.144 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.64 32.29 0.23 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.472 -0.768 . . . . 0.0 109.751 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.606 ' O ' ' HB1' ' A' ' 106' ' ' ALA . 0.0 OUTLIER -137.89 168.87 18.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.736 0.779 . . . . 0.0 111.434 -179.717 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -73.14 170.79 12.38 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.62 -0.675 . . . . 0.0 112.128 -179.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.508 ' HB3' HD13 ' A' ' 102' ' ' LEU . 38.1 Cg_endo -63.35 -30.56 73.09 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 121.538 1.492 . . . . 0.0 110.194 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.617 ' HA ' ' ND1' ' A' ' 117' ' ' HIS . 6.6 m-30 -69.48 -35.96 76.07 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 118.253 -1.379 . . . . 0.0 109.018 177.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.845 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 10.0 t-80 -70.35 -30.99 68.08 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 117.028 -1.869 . . . . 0.0 109.712 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.822 HD13 ' HG ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -58.74 -43.18 90.17 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 176.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.675 ' NE2' ' CD2' ' A' ' 102' ' ' LEU . 7.4 m170 -58.66 -44.04 90.03 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.23 -35.69 72.07 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.52 -0.738 . . . . 0.0 110.141 177.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.627 ' C ' HD13 ' A' ' 119' ' ' LEU . 2.0 tm? -70.12 -46.9 63.84 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.843 -1.16 . . . . 0.0 108.87 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.573 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.254 0.5 OUTLIER -49.93 -40.2 42.62 Favored 'General case' 0 N--CA 1.515 2.808 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.779 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.714 ' HD2' ' HA ' ' A' ' 126' ' ' MET 0.257 0.4 OUTLIER -70.44 -47.13 62.12 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.532 -0.73 . . . . 0.0 109.893 177.692 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.08 -54.07 50.88 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.594 -0.692 . . . . 0.0 110.0 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.917 HG22 HD22 ' A' ' 84' ' ' LEU . 1.4 m -69.14 -60.49 2.31 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.488 -0.758 . . . . 0.0 110.381 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.697 ' N ' HD21 ' A' ' 84' ' ' LEU . 1.4 t -49.61 -32.69 13.42 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.64 -1.287 . . . . 0.0 108.137 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.526 ' O ' ' CG ' ' A' ' 126' ' ' MET . . . 110.6 -40.38 2.57 Favored Glycine 0 N--CA 1.494 2.527 0 CA-C-O 118.337 -1.257 . . . . 0.0 113.86 178.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.714 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 23.5 mtm -160.19 48.15 0.26 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.443 3.122 . . . . 0.0 114.823 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.929 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.3 m -171.51 91.2 0.44 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 120.511 -1.368 . . . . 0.0 110.149 176.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.648 ' CD ' ' HB2' ' A' ' 121' ' ' LYS . 48.4 Cg_endo -67.21 -114.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.666 0 O-C-N 122.322 0.643 . . . . 0.0 113.157 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.913 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 4.2 ttmt -58.04 -21.87 47.46 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.79 -1.194 . . . . 0.0 111.106 -178.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.5 ' HB3' HG22 ' A' ' 127' ' ' THR . . . -68.17 -34.68 76.75 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.117 -0.989 . . . . 0.0 108.54 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.929 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.41 -40.76 96.4 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.622 -1.299 . . . . 0.0 107.841 175.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 91' ' ' CYS . 0.9 OUTLIER -59.05 -39.07 80.92 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.132 -1.027 . . . . 0.0 108.857 178.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.81 -45.56 81.86 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 110.022 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.38 -58.1 9.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 109.77 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.503 ' CD1' HG23 ' A' ' 88' ' ' THR 0.252 0.1 OUTLIER -44.98 -48.9 11.44 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 122.057 0.932 . . . . 0.0 109.687 178.566 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.539 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 0.1 OUTLIER -60.32 -34.58 74.0 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.021 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -70.75 -34.56 71.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 110.255 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -100.54 -0.25 38.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.307 -0.87 . . . . 0.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 121.106 -0.996 . . . . 0.0 110.469 -179.957 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.55 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.405 -11.322 1 C3'-C2'-C1' 114.703 8.574 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.55 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.4 -11.765 3 C3'-C2'-C1' 113.655 7.825 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.532 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.945 1 C3'-C2'-C1' 114.891 8.708 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.536 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.158 2 C3'-C2'-C1' 115.009 8.792 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 195' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.407 -11.09 2 C3'-C2'-C1' 114.797 8.641 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.596 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.418 -9.976 2 C3'-C2'-C1' 114.18 8.2 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.614 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.409 -10.858 2 C3'-C2'-C1' 114.201 8.215 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.614 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.975 2 C3'-C2'-C1' 114.949 8.749 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.525 " H4'" ' O ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.863 2 C3'-C2'-C1' 114.759 8.613 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.616 H2'' " O5'" ' B' ' 200' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.411 -10.661 1 C3'-C2'-C1' 115.142 8.887 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.616 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.417 -10.104 2 C3'-C2'-C1' 114.67 8.55 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.845 ' C6 ' ' NE2' ' A' ' 115' ' ' HIS . . . . . . . . 4 C3'--C2' 1.409 -10.874 1 C3'-C2'-C1' 114.509 8.435 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.693 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.41 -10.819 1 C3'-C2'-C1' 114.558 8.47 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.581 ' N3 ' ' C2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.529 2 C3'-C2'-C1' 114.653 8.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.549 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.231 2 C3'-C2'-C1' 115.847 9.391 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.549 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.41 -10.773 2 C3'-C2'-C1' 114.954 8.753 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.507 " O5'" H2'' ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.42 -9.804 2 C3'-C2'-C1' 114.904 8.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.488 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.255 2 C3'-C2'-C1' 114.738 8.599 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . 0.54 ' C4 ' ' N4 ' ' C' ' 222' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.407 -11.102 2 C3'-C2'-C1' 114.397 8.355 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.569 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.077 2 C3'-C2'-C1' 114.564 8.475 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.88 " H3'" ' HD2' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.416 -10.211 1 C3'-C2'-C1' 114.714 8.582 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.913 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.414 -10.436 1 C3'-C2'-C1' 114.939 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.52 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.042 1 C3'-C2'-C1' 114.938 8.742 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.52 " O5'" H2'' ' C' ' 225' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.42 -9.798 2 C3'-C2'-C1' 114.499 8.428 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.524 ' C2 ' ' N2 ' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.417 -10.138 1 C3'-C2'-C1' 115.259 8.971 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.518 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.422 -9.643 2 C3'-C2'-C1' 114.799 8.642 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.511 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.378 1 C3'-C2'-C1' 114.847 8.676 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.533 " H2'" ' H71' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.104 1 C3'-C2'-C1' 114.814 8.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.6 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.933 2 C3'-C2'-C1' 114.965 8.761 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.6 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.293 2 C3'-C2'-C1' 115.189 8.921 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.406 -11.202 1 C3'-C2'-C1' 114.622 8.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.894 ' OP2' HD12 ' A' ' 36' ' ' ILE . . . . . . . . 2 C3'--C2' 1.411 -10.674 2 C3'-C2'-C1' 114.923 8.731 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.842 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.412 -10.575 2 C3'-C2'-C1' 115.494 9.139 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.466 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.263 2 C3'-C2'-C1' 114.801 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.41 -10.785 2 C3'-C2'-C1' 114.586 8.49 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.429 2 C3'-C2'-C1' 114.287 8.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptp . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.149 0.5 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.428 ' C ' ' HG3' ' A' ' 3' ' ' LYS . 10.3 mmtp -84.57 -169.82 2.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.269 -0.894 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.758 ' O ' ' N ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -139.25 86.42 2.13 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.404 -0.81 . . . . 0.0 110.633 -179.537 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.627 ' HA ' ' H ' ' A' ' 8' ' ' THR . . . -39.39 72.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.549 -0.719 . . . . 0.0 112.824 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.758 ' N ' ' O ' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -73.69 70.49 1.37 Allowed 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 177.601 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 5' ' ' THR . 68.3 m 95.17 28.19 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER 81.47 88.97 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 123.951 1.834 . . . . 0.0 111.341 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.627 ' H ' ' HA ' ' A' ' 4' ' ' ALA . 19.2 m -79.59 64.66 4.53 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 112.015 -2.357 . . . . 0.0 106.972 177.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.653 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 4.1 p-10 -39.42 -28.45 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.187 -179.039 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.8 OUTLIER -52.04 -49.02 64.26 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 121.225 -0.922 . . . . 0.0 108.832 177.63 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.521 ' H ' HG22 ' A' ' 8' ' ' THR . 2.8 tp60 -78.61 -29.82 46.22 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 117.251 -1.779 . . . . 0.0 108.658 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.904 ' O ' HG23 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -50.83 -41.79 57.88 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 177.236 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 1.049 ' CZ2' HD21 ' A' ' 17' ' ' LEU . 31.9 t-105 -62.22 -40.84 97.45 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -60.92 -29.85 69.85 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.64 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -30.55 61.39 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 12' ' ' ARG . 39.2 t -75.08 -29.26 21.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-O 122.253 1.025 . . . . 0.0 111.361 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.049 HD21 ' CZ2' ' A' ' 13' ' ' TRP 0.253 1.5 mt -93.74 -31.77 14.28 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-O 122.197 0.999 . . . . 0.0 108.576 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.688 ' O ' ' CG ' ' A' ' 19' ' ' ARG . . . -77.01 -16.89 59.17 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.478 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.688 ' CG ' ' O ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER 67.53 38.49 3.1 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.998 0.904 . . . . 0.0 109.967 -179.023 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.467 ' C ' ' H ' ' A' ' 22' ' ' ASN . 38.1 t0 -70.09 110.16 6.18 Favored Pre-proline 0 C--N 1.299 -1.601 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 20' ' ' ASP . 40.3 Cg_endo -65.68 6.42 0.45 Allowed 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 121.221 1.28 . . . . 0.0 110.432 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.476 ' C ' HD21 ' A' ' 78' ' ' ASN 0.303 1.1 t30 -100.21 -11.08 20.71 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.913 0.863 . . . . 0.0 109.2 -178.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.991 ' HB1' ' CE2' ' A' ' 27' ' ' PHE . . . -102.23 -6.02 23.66 Favored 'General case' 0 C--N 1.292 -1.925 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.163 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.978 ' OD1' ' HG2' ' A' ' 39' ' ' ARG . 30.2 t0 -80.12 127.35 32.21 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.842 ' N ' ' HB1' ' A' ' 77' ' ' ALA . . . 100.82 -38.1 3.29 Favored Glycine 0 N--CA 1.508 3.451 0 N-CA-C 105.409 -3.076 . . . . 0.0 105.409 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -37.39 64.61 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.991 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 4.9 p90 -162.69 170.69 18.02 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.484 1.135 . . . . 0.0 111.006 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' ' 55' ' ' TYR . 0.9 OUTLIER -129.47 175.69 10.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.309 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 177.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -138.04 119.9 15.32 Favored 'General case' 0 C--N 1.281 -2.387 0 C-N-CA 117.697 -1.601 . . . . 0.0 109.153 176.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 37' ' ' PHE . . . -97.8 113.66 25.51 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.817 -1.083 . . . . 0.0 113.286 -175.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.042 HG12 HG22 ' A' ' 33' ' ' THR . 2.5 t -87.16 100.07 9.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' ASN 0.264 0.1 OUTLIER -61.52 -20.07 62.81 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.91 0.862 . . . . 0.0 111.089 -179.074 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.042 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -64.16 -31.75 73.06 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-O 121.871 0.843 . . . . 0.0 108.828 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.665 HG21 ' OP2' ' C' ' 234' ' ' ' DT' . 8.9 t -119.59 3.05 11.22 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.065 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.74 35.88 90.68 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.886 HD12 ' OP2' ' C' ' 234' ' ' ' DT' . 55.4 mt -124.04 165.1 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.109 -1.23 . . . . 0.0 109.08 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.75 ' CG ' ' HB1' ' A' ' 61' ' ' ALA . 3.0 p90 -145.67 118.22 8.56 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 175.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SMC . . . . . 0.548 ' HB2' ' HB2' ' A' ' 42' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.978 ' HG2' ' OD1' ' A' ' 24' ' ' ASP 0.371 62.1 mtt180 -83.71 178.11 2.61 Favored Pre-proline 0 C--N 1.285 -2.196 0 CA-C-N 113.485 -1.689 . . . . 0.0 106.75 178.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.747 ' CA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 Cg_endo -76.01 -18.72 16.42 Favored 'Trans proline' 0 C--N 1.289 -2.562 0 N-CA-C 108.272 -1.472 . . . . 0.0 108.272 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 5.1 p -115.31 30.77 7.14 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.175 -0.953 . . . . 0.0 112.926 -178.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 38' ' ' SMC . 49.3 t -48.6 138.53 10.52 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.617 -1.302 . . . . 0.0 109.58 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.741 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -101.08 6.31 43.27 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.488 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.741 ' HB2' ' NH1' ' A' ' 43' ' ' ARG . . . -89.65 -50.84 5.84 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.702 -1.249 . . . . 0.0 112.501 -178.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.678 ' HB2' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER 171.27 175.53 0.07 Allowed 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 -179.072 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.921 ' O ' " O3'" ' C' ' 234' ' ' ' DT' . 5.3 m-70 -136.81 158.49 44.33 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.215 -1.553 . . . . 0.0 113.957 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.624 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -120.24 159.39 25.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.096 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mt -53.93 158.32 2.12 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.236 -0.915 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.632 ' HA ' ' HB ' ' A' ' 52' ' ' VAL 0.288 6.0 ttt85 -63.1 -30.53 71.67 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 122.691 1.234 . . . . 0.0 109.123 179.032 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.274 0.7 OUTLIER -40.33 -62.38 0.77 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.023 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.844 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 74.7 m-80 -90.0 17.22 7.08 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 31' ' ' VAL . 2.2 t -116.02 124.41 72.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 O-C-N 121.758 -0.589 . . . . 0.0 111.124 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.767 ' O ' ' HA ' ' A' ' 29' ' ' PHE . 3.2 p -121.8 175.15 6.43 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 94.6 m-85 -119.2 150.26 40.36 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.358 1.075 . . . . 0.0 112.201 -177.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.789 ' HB2' HG22 ' A' ' 28' ' ' VAL . 45.5 m-85 -130.31 154.79 47.27 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.442 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.09 -40.17 78.56 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.536 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.6 p30 -140.49 168.87 18.78 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.414 1.102 . . . . 0.0 110.688 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 62' ' ' LEU . . . -64.85 -25.49 67.92 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.124 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.596 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.8 t -70.05 -36.9 75.34 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 118.595 -1.242 . . . . 0.0 109.044 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.427 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 9.2 tp10 -61.56 -49.19 77.64 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 177.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.75 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -58.74 -44.21 90.44 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.774 HD21 ' HG3' ' A' ' 68' ' ' PRO . 65.3 mt -61.66 -28.04 69.1 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -80.09 -16.86 54.09 Favored 'General case' 0 C--N 1.311 -1.073 0 O-C-N 121.632 -0.668 . . . . 0.0 110.321 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.2 0.2 29.4 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.244 -0.91 . . . . 0.0 110.433 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 84.14 39.87 8.97 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.433 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 8.0 m-85 -114.31 160.6 18.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.347 -1.09 . . . . 0.0 111.627 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -99.87 114.57 65.71 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 177.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.774 ' HG3' HD21 ' A' ' 62' ' ' LEU . 36.7 Cg_endo -62.45 139.27 75.63 Favored 'Trans proline' 0 C--N 1.303 -1.85 0 O-C-N 123.642 1.338 . . . . 0.0 110.491 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.573 ' HA ' ' OP1' ' C' ' 233' ' ' ' DA' . 3.0 t -58.11 119.73 7.34 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.703 0.764 . . . . 0.0 109.645 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -6.77 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -109.42 -37.01 5.84 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 122.19 0.995 . . . . 0.0 109.5 -179.113 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 35.0 m -86.93 -14.61 41.33 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.615 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.728 ' HB2' ' HB2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -88.13 -36.93 0.46 Allowed Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 73' ' ' GLN . 45.8 Cg_endo -72.08 -46.07 0.59 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 122.739 0.863 . . . . 0.0 112.064 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.626 ' OD2' ' NH1' ' A' ' 39' ' ' ARG . 44.2 p30 -76.95 178.15 7.16 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.014 -1.054 . . . . 0.0 111.126 -178.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 80' ' ' ARG . 5.7 mmtt -101.98 140.6 36.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.367 -0.833 . . . . 0.0 111.609 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.842 ' HB1' ' N ' ' A' ' 25' ' ' GLY . . . -80.04 -116.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.422 -0.799 . . . . 0.0 110.471 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.025 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 5.4 m120 -58.8 -30.5 7.87 Favored Pre-proline 0 N--CA 1.505 2.317 0 O-C-N 119.333 -2.104 . . . . 0.0 108.395 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 1.025 ' HD2' ' N ' ' A' ' 78' ' ' ASN . 54.0 Cg_endo -59.74 -18.28 47.57 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 N-CA-C 107.195 -1.886 . . . . 0.0 107.195 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.738 ' HB2' ' O ' ' A' ' 77' ' ' ALA . 3.5 ttt180 -53.91 -67.99 0.22 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -49.19 -34.51 14.77 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.105 -0.997 . . . . 0.0 112.236 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -68.81 -42.11 77.71 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.06 -1.025 . . . . 0.0 108.996 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.494 ' O ' HG13 ' A' ' 87' ' ' ILE . 0.5 OUTLIER -67.58 -22.29 65.39 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.823 HD21 ' CG2' ' A' ' 123' ' ' THR . 0.7 OUTLIER -77.69 -33.29 53.28 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 118.858 -1.137 . . . . 0.0 108.407 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -37.81 83.63 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -59.98 -48.63 80.92 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.041 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.788 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.1 mt -57.03 -41.09 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.797 -1.19 . . . . 0.0 110.227 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 91' ' ' CYS . 3.0 m -52.16 -47.76 65.29 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.209 -1.557 . . . . 0.0 107.608 177.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -55.39 -36.48 66.45 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.897 ' O ' HD12 ' A' ' 94' ' ' LEU . . . -54.77 -38.32 67.08 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 135' ' ' TRP . 25.0 t -62.09 -48.69 79.05 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 117.87 -1.532 . . . . 0.0 108.064 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.442 ' O ' ' N ' ' A' ' 96' ' ' GLN . 7.8 ttt-85 -48.42 -54.68 13.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.483 -0.761 . . . . 0.0 109.989 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 40.9 mt -56.15 -36.27 68.09 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.55 -0.719 . . . . 0.0 110.917 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.897 HD12 ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -68.59 -10.22 54.53 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 121.389 0.614 . . . . 0.0 109.854 -178.353 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.602 ' HG3' ' HG3' ' A' ' 136' ' ' ARG . 2.4 tm-20 -131.88 -10.06 3.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.371 -0.831 . . . . 0.0 110.666 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -90.17 -44.14 9.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.134 -0.979 . . . . 0.0 111.73 -178.456 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.753 ' OE2' ' O ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.2 -155.68 0.29 Allowed 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.812 -1.18 . . . . 0.0 111.822 -178.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.587 ' HB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 m -105.29 -65.36 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.495 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 177.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.753 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 39.6 Cg_endo -65.98 140.4 60.2 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 N-CA-C 107.758 -1.67 . . . . 0.0 107.758 175.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.7 151.73 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 120.312 -1.492 . . . . 0.0 110.674 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HB3' ' A' ' 93' ' ' LEU . 0.0 OUTLIER -112.45 99.37 7.93 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.673 1.225 . . . . 0.0 112.092 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.456 HD21 ' NE2' ' A' ' 117' ' ' HIS . 7.0 mt -131.55 -36.37 1.25 Allowed 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -40.12 -45.16 1.94 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.51 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.5 -40.51 80.83 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.635 -1.291 . . . . 0.0 110.19 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.617 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -72.11 -50.67 26.19 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 109.937 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 111' ' ' MET . . . -55.42 -40.86 72.0 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.317 -0.864 . . . . 0.0 109.859 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 3.3 m-20 -68.24 -36.2 79.1 Favored 'General case' 0 C--N 1.307 -1.246 0 O-C-N 121.526 -0.734 . . . . 0.0 110.626 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -39.66 80.81 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.258 -0.901 . . . . 0.0 111.021 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.769 ' O ' ' HB3' ' A' ' 110' ' ' ALA . 1.1 t -92.87 -17.02 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.21 -0.931 . . . . 0.0 110.373 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 109' ' ' VAL . . . 79.98 38.42 0.1 Allowed 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.655 -0.653 . . . . 0.0 112.485 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' MET . . . . . 0.532 ' SD ' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -140.44 162.01 36.35 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.794 -1.191 . . . . 0.0 112.253 178.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.45 ' HB2' ' HD2' ' A' ' 113' ' ' PRO . 1.0 OUTLIER -60.59 170.67 1.28 Allowed Pre-proline 0 N--CA 1.502 2.166 0 O-C-N 121.793 -0.567 . . . . 0.0 110.901 179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.45 ' HD2' ' HB2' ' A' ' 112' ' ' SER . 37.6 Cg_endo -61.6 -38.61 60.62 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 O-C-N 123.443 1.233 . . . . 0.0 111.521 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.561 ' CE2' ' H73' ' C' ' 223' ' ' ' DT' . 8.5 m-30 -69.5 -47.49 63.67 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 118.489 -1.284 . . . . 0.0 110.037 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.685 ' NE2' ' C6 ' ' B' ' 201' ' ' ' DC' . 3.5 t60 -70.61 -23.02 62.48 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 116.548 -2.061 . . . . 0.0 110.432 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.638 ' C ' HD13 ' A' ' 116' ' ' LEU . 3.4 tm? -64.79 -40.2 94.84 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 176.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 129' ' ' LYS . 28.5 m170 -61.76 -42.79 99.45 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.513 ' NH2' ' H41' ' C' ' 226' ' ' ' DC' . 5.6 mtp85 -58.05 -35.67 71.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.495 -0.753 . . . . 0.0 109.75 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.722 ' HG ' HG11 ' A' ' 109' ' ' VAL . 2.6 tm? -69.8 -44.64 69.65 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 120.861 -1.15 . . . . 0.0 108.734 177.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.613 ' CE2' HG22 ' A' ' 87' ' ' ILE 0.259 0.7 OUTLIER -49.59 -40.41 38.75 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.773 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.937 ' HB2' ' N ' ' A' ' 128' ' ' PRO . 1.0 OUTLIER -76.33 -42.07 46.2 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 120.918 -1.114 . . . . 0.0 110.308 177.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.46 -56.36 22.15 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.674 -0.641 . . . . 0.0 109.536 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.823 ' CG2' HD21 ' A' ' 84' ' ' LEU . 1.3 m -69.53 -55.71 9.4 Favored 'General case' 0 N--CA 1.504 2.258 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.436 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.675 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 1.4 t -51.9 -32.31 32.03 Favored 'General case' 0 N--CA 1.52 3.065 0 O-C-N 120.486 -1.384 . . . . 0.0 107.849 176.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.491 ' O ' ' HG3' ' A' ' 126' ' ' MET . . . 111.38 -40.26 2.61 Favored Glycine 0 N--CA 1.495 2.581 0 CA-C-O 117.715 -1.603 . . . . 0.0 114.801 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.537 ' O ' ' OG1' ' A' ' 127' ' ' THR . 0.4 OUTLIER -157.98 48.54 0.39 Allowed 'General case' 0 N--CA 1.518 2.962 0 CA-C-N 123.6 3.7 . . . . 0.0 116.223 179.107 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 1.105 HG21 ' CE3' ' A' ' 131' ' ' TRP . 1.4 m -171.34 86.68 0.47 Allowed Pre-proline 0 N--CA 1.498 1.968 0 O-C-N 119.96 -1.712 . . . . 0.0 111.044 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.937 ' N ' ' HB2' ' A' ' 121' ' ' LYS . 52.2 Cg_endo -71.47 -118.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 N-CA-C 113.671 0.604 . . . . 0.0 113.671 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.989 ' HB3' ' OP2' ' C' ' 224' ' ' ' DT' . 0.0 OUTLIER -53.52 -23.57 10.85 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.064 -1.022 . . . . 0.0 110.935 -178.036 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.502 ' N ' ' OP1' ' C' ' 224' ' ' ' DT' . . . -68.32 -38.03 81.15 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.789 -1.194 . . . . 0.0 109.241 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 1.105 ' CE3' HG21 ' A' ' 127' ' ' THR . 0.0 OUTLIER -64.46 -34.31 77.9 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.326 -1.484 . . . . 0.0 108.405 176.644 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.792 ' CD ' HD22 ' A' ' 94' ' ' LEU . 3.6 tm0? -67.13 -46.17 74.9 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.589 178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -63.34 -49.59 73.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 110.754 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.02 -60.11 4.24 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.26 -0.9 . . . . 0.0 111.056 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.785 ' HB2' ' SG ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -48.39 -45.16 35.52 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.259 -0.901 . . . . 0.0 110.032 179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.602 ' HG3' ' HG3' ' A' ' 95' ' ' GLU . 4.4 ttt180 -62.32 -28.9 70.06 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 121.305 0.574 . . . . 0.0 111.123 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.76 -24.67 31.02 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.761 -0.776 . . . . 0.0 110.384 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 ttm-85 -100.72 -28.63 12.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.151 -0.968 . . . . 0.0 109.288 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.283 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 190' ' ' ' DG' . . . . . 0.494 ' C5 ' ' N4 ' ' B' ' 191' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.406 -11.222 1 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 191' ' ' ' DC' . . . . . 0.494 ' N4 ' ' C5 ' ' B' ' 190' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.401 -11.662 2 C3'-C2'-C1' 113.621 7.801 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 192' ' ' ' DA' . . . . . 0.501 H2'' " O5'" ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.419 -9.884 1 C3'-C2'-C1' 115.02 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 193' ' ' ' DA' . . . . . 0.565 H2'' " O5'" ' B' ' 194' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.204 1 C3'-C2'-C1' 114.947 8.748 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 194' ' ' ' DA' . . . . . 0.565 " O5'" H2'' ' B' ' 193' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.411 -10.723 2 C3'-C2'-C1' 114.762 8.616 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 195' ' ' ' DT' . . . . . 0.562 H2'' " O5'" ' B' ' 196' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.417 -10.056 2 C3'-C2'-C1' 114.238 8.242 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 196' ' ' ' DT' . . . . . 0.626 H2'' " O5'" ' B' ' 197' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.408 -10.966 1 C3'-C2'-C1' 114.241 8.243 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 197' ' ' ' DA' . . . . . 0.626 " O5'" H2'' ' B' ' 196' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.417 -10.084 2 C3'-C2'-C1' 114.963 8.759 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 198' ' ' ' DA' . . . . . 0.487 " H4'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.419 -9.943 1 C3'-C2'-C1' 114.872 8.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' ' DA' . . . . . 0.582 " H5'" ' CB ' ' A' ' 43' ' ' ARG . . . . . . . . 2 C3'--C2' 1.41 -10.76 1 C3'-C2'-C1' 115.136 8.883 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' ' DG' . . . . . 0.576 " O5'" H2'' ' B' ' 199' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.418 -9.962 2 C3'-C2'-C1' 114.544 8.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' ' DC' . . . . . 0.696 " O5'" ' H6 ' ' B' ' 201' ' ' ' DC' . . . . . . . . 3 C3'--C2' 1.409 -10.903 1 C3'-C2'-C1' 114.495 8.425 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . 0.668 " O5'" H2'' ' B' ' 201' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.409 -10.862 1 C3'-C2'-C1' 114.631 8.522 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' ' DC' . . . . . 0.564 " O5'" H2'' ' B' ' 202' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.413 -10.509 2 C3'-C2'-C1' 114.591 8.494 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . 0.52 H2'' " O5'" ' B' ' 205' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.416 -10.229 2 C3'-C2'-C1' 115.811 9.365 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 204' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.413 -10.545 2 C3'-C2'-C1' 114.901 8.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' ' DG' . . . . . 0.54 ' C6 ' ' C6 ' ' B' ' 207' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.421 -9.731 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' ' DA' . . . . . 0.54 ' C6 ' ' C6 ' ' B' ' 206' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.415 -10.3 2 C3'-C2'-C1' 114.727 8.591 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C3'--C2' 1.406 -11.244 2 C3'-C2'-C1' 114.182 8.202 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . 0.583 " H2'" ' H72' ' C' ' 223' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.252 2 C3'-C2'-C1' 114.641 8.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 223' ' ' ' DT' . . . . . 0.583 ' H72' " H2'" ' C' ' 222' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.417 -10.07 1 C3'-C2'-C1' 114.65 8.536 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 224' ' ' ' DT' . . . . . 0.989 ' OP2' ' HB3' ' A' ' 129' ' ' LYS . . . . . . . . 2 C3'--C2' 1.415 -10.278 1 C3'-C2'-C1' 114.82 8.657 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 225' ' ' ' DG' . . . . . 0.468 H2'' " O5'" ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -10.045 1 C3'-C2'-C1' 114.977 8.769 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 226' ' ' ' DC' . . . . . 0.621 H2'' " O5'" ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.421 -9.704 2 C3'-C2'-C1' 114.511 8.436 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 227' ' ' ' DG' . . . . . 0.621 " O5'" H2'' ' C' ' 226' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.418 -9.955 1 C3'-C2'-C1' 115.133 8.88 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 228' ' ' ' DC' . . . . . 0.452 " O5'" H2'' ' C' ' 227' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.419 -9.865 2 C3'-C2'-C1' 114.663 8.545 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 229' ' ' ' DT' . . . . . 0.492 H2'' " O5'" ' C' ' 230' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.414 -10.424 1 C3'-C2'-C1' 114.915 8.725 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 230' ' ' ' DT' . . . . . 0.492 " O5'" H2'' ' C' ' 229' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.418 -9.976 1 C3'-C2'-C1' 114.8 8.643 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 231' ' ' ' DT' . . . . . 0.609 H2'' " O5'" ' C' ' 232' ' ' ' DA' . . . . . . . . 2 C3'--C2' 1.409 -10.879 2 C3'-C2'-C1' 114.87 8.693 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 232' ' ' ' DA' . . . . . 0.609 " O5'" H2'' ' C' ' 231' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.416 -10.23 2 C3'-C2'-C1' 115.024 8.803 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 233' ' ' ' DA' . . . . . 0.611 " O4'" ' HB1' ' A' ' 44' ' ' ALA . . . . . . . . 2 C3'--C2' 1.405 -11.312 2 C3'-C2'-C1' 114.625 8.518 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 234' ' ' ' DT' . . . . . 0.921 " O3'" ' O ' ' A' ' 46' ' ' HIS . . . . . . . . 2 C3'--C2' 1.414 -10.424 2 C3'-C2'-C1' 114.843 8.673 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 235' ' ' ' DT' . . . . . 0.799 ' H71' " H2'" ' C' ' 234' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.411 -10.675 2 C3'-C2'-C1' 115.505 9.147 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 236' ' ' ' DT' . . . . . 0.486 " O5'" H2'' ' C' ' 235' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.415 -10.345 2 C3'-C2'-C1' 114.797 8.64 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 237' ' ' ' DG' . . . . . 0.405 " O5'" H2'' ' C' ' 236' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.408 -10.964 2 C3'-C2'-C1' 114.723 8.588 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 020 nuclear nobuild full ' C' C ' 238' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 2 C3'--C2' 1.414 -10.384 2 C3'-C2'-C1' 114.239 8.242 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_