data_5o9b_residue ############################ # Computer software used # ############################ 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 5o9b _Structure_validation_residue.Date_analyzed 2019-02-01 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 ' 5' ' ' THR . . . . . 0.61 ' O ' HG21 ' A' ' 13' ' ' THR . 1.2 m . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.009 -0.043 . . . . 1.09 111.019 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.56 ' H ' HG21 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 1.61 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.571 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 1.04 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.571 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.7 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 1.28 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 2.37 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 1.06 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.61 HG21 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 1.09 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.525 ' O ' HG21 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.72 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.514 HG23 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 1.08 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 1.2 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.514 ' H ' HG23 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 1.37 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.76 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 4.37 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.25 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 1.08 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 2.11 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.509 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.27 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.535 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.535 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.29 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 1.03 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.466 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.555 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.442 ' HB3' ' CD ' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 1.02 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.42 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 1.27 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 1.02 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 1.04 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.82 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.77 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.444 ' O ' HG21 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.87 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 2.35 111.953 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 1.25 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.442 ' CD ' ' HB3' ' A' ' 30' ' ' ALA . 20.0 ttt180 . . . . . 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 4.01 110.693 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.605 HG21 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 110.59 -0.152 . . . . 1.09 110.59 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.605 ' H ' HG21 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 1.61 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.523 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 1.04 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.523 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.7 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 1.28 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 2.37 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 1.06 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.571 HG23 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 1.09 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.72 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.568 HG21 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 1.08 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 1.2 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.73 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 1.37 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.73 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.76 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.527 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 4.37 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.25 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.709 ' HB1' ' HH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 1.08 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 2.11 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.27 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.642 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.642 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.29 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 1.03 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.658 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 1.02 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.42 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 1.27 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 1.02 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.709 ' HH ' ' HB1' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 1.04 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.82 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.77 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.87 113.991 -160.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 2.35 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 1.25 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 4.01 110.659 -175.675 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.664 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m . . . . . 0 C--O 1.223 -0.34 0 N-CA-C 110.554 -0.165 . . . . 1.09 110.554 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.547 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 1.61 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 1.04 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.577 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.2 t30 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.7 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.408 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 1.28 112.275 -175.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 2.37 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 1.06 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 1.09 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.72 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.538 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 1.08 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 1.2 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.538 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 1.37 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.76 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 4.37 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.25 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 1.08 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 2.11 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.27 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.613 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.613 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.29 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.562 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 1.03 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.664 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 1.02 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.562 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.42 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.759 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.795 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 1.27 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.463 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 1.02 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 1.04 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.759 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.82 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.795 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.77 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.87 114.084 -165.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 2.35 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 1.25 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 4.01 109.342 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.036 0.013 . . . . 1.09 111.036 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.581 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 1.61 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 1.04 113.803 178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.7 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 1.28 111.337 -171.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 2.37 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 1.06 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.575 HG21 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 1.09 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.72 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 1.08 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 1.2 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.554 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 1.37 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.76 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 4.37 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.25 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.615 ' HB3' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 1.08 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 2.11 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.27 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.592 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.29 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 1.03 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.455 ' CA ' HG23 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 1.02 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.449 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.42 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.719 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.718 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 1.27 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.469 ' CE2' ' HD2' ' A' ' 38' ' ' HIS . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 1.02 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.615 ' OH ' ' HB3' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 1.04 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.719 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.82 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.77 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.469 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 50.0 m-70 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.87 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 2.35 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 1.25 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.468 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 2.7 tmt_? . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 4.01 109.151 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 111.148 0.055 . . . . 1.09 111.148 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.57 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 1.61 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.507 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 1.04 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.507 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.7 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 1.28 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 2.37 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 1.06 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 1.09 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.72 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.615 HG21 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 1.08 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 1.2 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.615 ' H ' HG21 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 1.37 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.593 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.76 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 4.37 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.25 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 1.08 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 2.11 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.27 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.498 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.29 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 1.03 109.293 178.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.407 ' CA ' HG22 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.474 HD22 HD13 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 1.02 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.42 111.661 -175.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 1.27 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.702 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 1.02 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 1.04 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.82 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.77 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.87 114.601 -161.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 2.35 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 1.25 109.914 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.702 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 4.01 110.414 -174.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.713 ' O ' HG23 ' A' ' 13' ' ' THR . 0.7 OUTLIER . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 109.926 -0.398 . . . . 1.09 109.926 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.533 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 1.61 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 1.04 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.0 t30 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.7 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.436 ' C ' ' H ' ' A' ' 12' ' ' THR . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 1.28 112.513 -175.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 2.37 113.529 -172.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 1.06 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.713 HG23 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 1.09 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.72 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.505 HG21 ' H ' ' A' ' 17' ' ' LEU . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 1.08 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 1.2 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.584 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 1.37 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.447 ' HH2' ' O ' ' A' ' 12' ' ' THR . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.589 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.76 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 4.37 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.25 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 1.08 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 2.11 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.504 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.27 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.505 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.505 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.29 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.561 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 1.03 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.439 ' CA ' HG22 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.417 ' H ' HG22 ' A' ' 15' ' ' THR . 1.5 t-20 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 1.02 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.561 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.42 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.589 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.814 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 1.27 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.594 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 1.02 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 1.04 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.82 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.814 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.77 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.418 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 64.4 m-70 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.87 114.436 -166.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 2.35 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 1.25 109.768 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.594 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 4.01 109.062 -174.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.589 HG23 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 110.35 -0.241 . . . . 1.09 110.35 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.589 ' H ' HG23 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 1.61 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 1.04 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.4 t30 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.7 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 12' ' ' THR . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 1.28 112.131 -175.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 2.37 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 10' ' ' CYS . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 1.06 109.271 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 1.09 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.497 ' O ' HG21 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.72 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.499 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 1.08 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 1.2 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 1.37 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.76 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 4.37 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.25 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.444 ' HB2' ' HH ' ' A' ' 35' ' ' TYR . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 1.08 113.349 -173.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 2.11 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.27 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.474 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.29 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 1.03 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.565 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 1.02 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.698 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.42 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.717 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.669 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 1.27 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 1.02 111.414 -173.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.444 ' HH ' ' HB2' ' A' ' 22' ' ' ALA . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 1.04 110.558 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.717 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.82 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.77 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.462 ' O ' HG21 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.87 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 2.35 111.972 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 1.25 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.698 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 . . . . . 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 4.01 110.433 -174.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 6' ' ' CYS . 4.7 m . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 110.586 -0.153 . . . . 1.09 110.586 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.553 ' H ' HG23 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 1.61 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.488 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 1.04 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.488 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.7 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 1.28 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 2.37 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 1.06 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.537 HG21 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 1.09 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.528 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.72 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 1.08 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 1.2 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.555 ' H ' HG23 ' A' ' 15' ' ' THR . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 1.37 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.76 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 4.37 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.25 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 1.08 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 2.11 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.477 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.27 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.627 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.29 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 1.03 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.457 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 1.02 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.425 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.42 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.683 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.673 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 1.27 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 1.02 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 1.04 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.627 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.82 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.673 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.77 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.87 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 2.35 112.202 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 1.25 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.527 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 4.01 110.772 -167.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 119.986 -0.054 . . . . 1.09 111.116 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.431 ' H ' HG21 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 1.61 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 1.04 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.7 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 1.28 112.308 -173.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 2.37 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 1.06 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 1.09 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.475 HG23 ' O ' ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.72 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 1.08 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 1.2 111.584 -178.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.577 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 1.37 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.489 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.76 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 4.37 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.25 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 1.08 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 2.11 108.196 -173.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.514 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.27 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.29 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 1.03 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.452 ' CA ' HG23 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.492 ' H ' HG23 ' A' ' 15' ' ' THR . 0.9 OUTLIER -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 1.02 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.42 111.614 -173.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.569 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 1.27 109.585 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 1.02 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 1.04 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.82 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.77 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.87 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 2.35 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.4 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 1.25 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 4.01 110.154 -176.212 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.42 ' O ' HG21 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.635 -0.135 . . . . 1.09 110.635 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 1.61 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 1.04 113.4 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.7 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 1.28 111.775 -172.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 2.37 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 1.06 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.42 HG21 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 1.09 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.72 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.578 HG21 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 1.08 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 1.2 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.578 ' H ' HG21 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 1.37 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.76 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 4.37 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.25 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 1.08 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 2.11 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.513 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.27 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.532 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.29 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 1.03 109.09 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.412 ' CA ' HG22 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 1.02 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.42 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 1.27 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.414 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 1.02 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 1.04 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.82 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.77 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.87 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 2.35 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 1.25 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 2.0 tmt_? . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 4.01 109.192 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.595 HG21 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 CA--C 1.534 0.349 0 N-CA-C 110.634 -0.136 . . . . 1.09 110.634 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.595 ' H ' HG21 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 1.61 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.591 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 1.04 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.591 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.8 t30 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.7 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 12' ' ' THR . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 1.28 111.953 -175.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 2.37 113.772 -171.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 10' ' ' CYS . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 1.06 108.911 171.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 1.09 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.613 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.72 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 1.08 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 1.2 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.536 ' H ' HG21 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 1.37 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.76 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.702 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 4.37 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.25 109.042 171.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.432 ' HB2' ' HH ' ' A' ' 35' ' ' TYR . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 1.08 113.99 -171.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 2.11 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.523 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.27 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.702 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.29 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 1.03 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.56 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 1.02 113.416 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.42 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.722 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.685 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 1.27 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 1.02 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HH ' ' HB2' ' A' ' 22' ' ' ALA . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 1.04 111.383 178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.82 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.77 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.87 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m120 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 2.35 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 1.25 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 4.01 110.872 -173.356 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 13' ' ' THR . 1.3 m . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 119.959 -0.067 . . . . 1.09 111.09 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.59 ' H ' HG21 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 1.61 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.596 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 1.04 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.596 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.6 t30 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.7 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 1.28 112.188 -175.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 2.37 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 1.06 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.608 HG23 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 1.09 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.72 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.451 HG21 ' CA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 1.08 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 1.2 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.652 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 1.37 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.406 ' HH2' ' O ' ' A' ' 12' ' ' THR . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.68 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.76 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 4.37 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.405 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.25 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.407 ' HB3' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 1.08 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 2.11 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.531 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.27 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.708 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.29 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 1.03 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.451 ' CA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.599 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 1.02 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.54 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.42 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.589 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 1.27 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 1.02 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 1.04 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.82 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.77 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.418 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.87 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 2.35 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 1.25 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.54 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 4.01 109.777 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.686 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 109.456 -0.572 . . . . 1.09 109.456 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.571 ' H ' HG23 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 1.61 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.538 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 1.04 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.538 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.7 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 1.28 112.189 -175.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 2.37 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 1.06 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.686 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 1.09 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.554 ' O ' HG22 ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.72 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 1.08 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 1.2 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.595 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 1.37 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.76 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 4.37 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.25 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 1.08 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 2.11 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.501 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.27 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.29 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 1.03 109.52 176.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.427 ' HB2' HD21 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 1.02 113.038 -177.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.42 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.751 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.624 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 1.27 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 1.02 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 1.04 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.751 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.82 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.77 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.404 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.87 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 2.35 112.093 176.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 1.25 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 . . . . . 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 4.01 110.738 -171.655 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 13' ' ' THR . 4.0 m . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 110.021 -0.363 . . . . 1.09 110.021 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.6 ' H ' HG21 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 1.61 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.571 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 1.04 112.979 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.571 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.3 t30 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.7 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.415 ' C ' ' H ' ' A' ' 12' ' ' THR . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 1.28 111.948 -175.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 2.37 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.415 ' H ' ' C ' ' A' ' 10' ' ' CYS . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 1.06 108.655 170.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 1.09 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.72 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.49 HG21 ' H ' ' A' ' 17' ' ' LEU . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 1.08 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 1.2 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.49 ' H ' HG21 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 1.37 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.76 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 4.37 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.25 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 1.08 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 2.11 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.27 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.591 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.29 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.514 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 1.03 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.445 ' CA ' HG22 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.421 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 1.02 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.42 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.629 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 1.27 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.482 ' HB2' HH11 ' A' ' 42' ' ' ARG . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 1.02 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 1.04 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.753 ' N ' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.82 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.77 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.87 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 2.35 111.91 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 38' ' ' HIS . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 1.25 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.588 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 4.01 110.117 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.506 HG21 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 110.637 -0.134 . . . . 1.09 110.637 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' HG21 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 1.61 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.525 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 1.04 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.525 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.7 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 1.28 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 2.37 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 1.06 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.501 HG23 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 1.09 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.583 ' O ' HG21 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.72 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.475 HG23 ' H ' ' A' ' 17' ' ' LEU . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 1.08 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 1.2 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.745 HD22 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 1.37 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.576 ' HD3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.76 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.516 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 4.37 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.25 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 1.08 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 2.11 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.27 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.658 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.29 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 1.03 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.461 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.745 ' OD1' HD22 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 1.02 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.521 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.42 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.576 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 1.27 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.539 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 1.02 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 1.04 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.82 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.77 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.87 114.077 -162.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 2.35 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 1.25 110.098 175.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.539 ' HG2' ' CB ' ' A' ' 34' ' ' TYR . 1.5 tmt_? . . . . . 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 4.01 109.37 -169.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 119.923 -0.084 . . . . 1.09 111.15 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.455 ' HA ' HG23 ' A' ' 13' ' ' THR . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 1.61 109.609 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 1.04 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.587 ' H ' ' C ' ' A' ' 7' ' ' CYS . 6.5 t30 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.7 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.425 ' C ' ' H ' ' A' ' 12' ' ' THR . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 1.28 111.788 -175.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 2.37 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 10' ' ' CYS . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 1.06 107.988 168.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 1.09 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.72 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.462 HG23 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 1.08 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 1.2 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.462 ' H ' HG23 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 1.37 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.454 ' NH1' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.76 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.523 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 4.37 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.25 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 1.08 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 2.11 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.523 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.27 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.29 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.608 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 1.03 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 1.02 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.608 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.42 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.79 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.668 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 1.27 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.601 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 1.02 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 1.04 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.82 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.77 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.418 ' O ' HG21 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.87 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 m120 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 2.35 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 1.25 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.601 ' HG2' ' CB ' ' A' ' 34' ' ' TYR . 1.4 tmt_? . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 4.01 110.543 -168.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.859 -0.115 . . . . 1.09 110.733 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.559 ' H ' HG21 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 1.61 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.582 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 1.04 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.582 ' H ' ' C ' ' A' ' 7' ' ' CYS . 11.2 t30 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.7 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.435 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 1.28 112.687 -174.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 2.37 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 1.06 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 1.09 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.72 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.416 HG21 ' H ' ' A' ' 17' ' ' LEU . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 1.08 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 1.2 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 1.37 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.76 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HG3' ' HA2' ' A' ' 24' ' ' GLY . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 4.37 110.151 176.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.25 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 1.08 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 2.11 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HG3' ' A' ' 20' ' ' ARG . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.27 110.975 -177.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.428 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.428 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.29 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 1.03 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.415 ' CA ' HG22 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.666 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.2 OUTLIER -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 1.02 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.42 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.468 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 1.27 108.813 174.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.522 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 1.02 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 1.04 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.82 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.77 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 80.2 m-70 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.87 114.405 -165.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 2.35 111.351 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 1.25 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 4.01 110.83 -173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 110.164 -0.31 . . . . 1.09 110.164 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.554 ' H ' HG23 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 1.61 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 1.04 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.554 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.2 t30 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.7 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.423 ' C ' ' H ' ' A' ' 12' ' ' THR . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 1.28 112.058 -176.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 2.37 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.433 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 1.06 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.47 HG22 ' HA ' ' A' ' 6' ' ' CYS . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 1.09 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.467 ' O ' HG21 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.72 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.459 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 1.08 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 1.2 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.811 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 1.37 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.433 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.811 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.76 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.413 ' HG3' ' HA2' ' A' ' 24' ' ' GLY . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 4.37 110.914 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.25 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 1.08 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 2.11 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.413 ' HA2' ' HG3' ' A' ' 20' ' ' ARG . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.27 112.105 177.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.29 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.575 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 1.03 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD22 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 1.02 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.42 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.565 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 1.27 108.801 174.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.628 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 1.02 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 1.04 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.565 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.82 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.77 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.87 114.559 -167.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 2.35 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 1.25 110.131 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.628 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 4.01 109.445 -174.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.471 ' O ' HG21 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.271 0.081 . . . . 1.09 111.03 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.467 ' H ' HG23 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 1.61 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.509 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 1.04 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.509 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.7 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 1.28 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 2.37 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 1.06 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 1.09 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.72 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.503 HG22 ' H ' ' A' ' 17' ' ' LEU . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 1.08 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 1.2 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.503 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 1.37 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.76 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 4.37 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.25 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 1.08 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 2.11 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.27 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.528 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.29 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 1.03 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.453 ' HA ' HG23 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.468 ' H ' HG23 ' A' ' 15' ' ' THR . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.403 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 1.02 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.42 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.744 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.63 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 1.27 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.406 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 1.02 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 1.04 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.744 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.82 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.77 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.87 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 2.35 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 1.25 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HB2' ' HB3' ' A' ' 34' ' ' TYR . 48.3 ttt180 . . . . . 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 4.01 110.38 -172.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.605 ' O ' HG23 ' A' ' 13' ' ' THR . 3.1 m . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 110.756 -0.091 . . . . 1.09 110.756 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.589 ' H ' HG23 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 1.61 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 1.04 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.542 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.7 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 1.28 111.873 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 2.37 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 1.06 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.605 HG23 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 1.09 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.41 ' O ' HG21 ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.72 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.574 HG23 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 1.08 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 1.2 110.489 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' H ' HG23 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 1.37 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.555 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.76 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.527 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 4.37 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.25 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 1.08 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 2.11 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.27 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.566 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.29 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 1.03 109.529 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.419 HD22 HD12 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 1.02 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.42 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.726 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.677 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 1.27 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 1.02 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 1.04 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.726 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.82 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.77 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.429 ' O ' HG21 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.87 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 2.35 112.063 176.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 1.25 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.48 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 2.4 tmt_? . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 4.01 109.512 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.123 -0.325 . . . . 17.59 110.123 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -157.36 47.02 0.4 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.245 0.545 . . . . 15.98 110.363 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -71.37 133.95 46.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 15.96 110.387 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -154.74 156.99 37.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.021 -0.536 . . . . 14.95 110.04 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -86.88 73.96 9.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.785 0.326 . . . . 13.19 111.369 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -91.48 101.98 14.65 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.465 -0.568 . . . . 12.27 109.465 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -75.4 83.73 2.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.511 0.672 . . . . 10.26 110.757 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -70.56 -21.24 62.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 10.28 110.251 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 47.5 p -94.43 75.75 3.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.289 -0.414 . . . . 7.15 109.993 176.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.5 p -60.26 116.88 4.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.046 -0.525 . . . . 6.15 110.708 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 111.54 -21.5 21.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.82 -0.705 . . . . 3.18 111.791 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.461 ' N ' HD21 ' A' ' -7' ' ' LEU . 1.4 mm? -117.9 87.78 2.78 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.647 -0.871 . . . . 2.72 108.647 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -141.02 73.84 1.44 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.757 0.651 . . . . 3.44 112.757 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.594 ' HB ' ' CD1' ' A' ' 33' ' ' LEU . 1.5 p -129.18 118.44 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.077 -0.712 . . . . 1.67 109.077 170.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.31 38.92 3.07 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.069 0.462 . . . . 3.56 111.166 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.527 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.1 m-85 -110.3 169.41 8.76 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.151 -0.685 . . . . 2.17 109.151 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 20.2 tm0? 67.98 -82.19 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.058 0.762 . . . . 3.2 113.058 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -154.43 -170.83 20.7 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.685 -0.769 . . . . 1.77 112.885 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -93.73 -96.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.257 2.638 . . . . 2.71 114.537 -175.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -154.89 -171.64 3.91 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 111.958 0.355 . . . . 6.04 111.958 -171.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.41 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 50.7 ttt180 -151.29 9.35 0.56 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.303 -0.408 . . . . 3.6 110.815 -177.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 68.02 -99.15 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.82 1.045 . . . . 1.31 113.82 174.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.96 69.08 0.28 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 121.362 -0.447 . . . . 0.7 112.713 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.61 ' O ' HG21 ' A' ' 13' ' ' THR . 1.2 m -120.13 -172.73 2.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.761 0.781 . . . . 1.09 111.019 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.56 ' H ' HG21 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 1.61 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.571 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 1.04 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.571 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.7 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 1.28 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 2.37 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 1.06 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.61 HG21 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 1.09 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.525 ' O ' HG21 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.72 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.514 HG23 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 1.08 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 1.2 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.514 ' H ' HG23 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 1.37 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.41 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.76 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 4.37 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.25 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 1.08 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 2.11 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.509 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.27 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.535 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.535 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.29 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 1.03 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.466 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.555 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.442 ' HB3' ' CD ' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 1.02 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.42 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 1.27 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 1.02 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 1.04 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.82 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.77 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.444 ' O ' HG21 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.87 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 2.35 111.953 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 1.25 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.55 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.442 ' CD ' ' HB3' ' A' ' 30' ' ' ALA . 20.0 ttt180 -94.13 108.7 37.53 Favored Pre-proline 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 4.01 110.693 -173.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 80.8 Cg_exo -53.89 118.48 5.0 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.137 1.891 . . . . 0.94 110.267 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tp -154.92 -72.95 0.12 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.565 -0.743 . . . . 2.33 110.74 -167.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.5 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.56 -156.74 0.77 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.547 -0.751 . . . . 3.66 109.466 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 46.9 ttm -80.76 -92.8 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.182 -0.607 . . . . 6.7 109.532 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -140.93 -31.39 0.6 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.795 -0.817 . . . . 10.87 108.795 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 tptt -126.27 71.64 1.28 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.518 -0.764 . . . . 10.51 108.941 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.5 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 42.7 mt-10 . . . . . 0 C--O 1.253 1.24 0 CA-C-N 115.449 -0.796 . . . . 7.0 110.829 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -18' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' -14' ' ' HIS . 25.6 mmt . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.922 0.391 . . . . 17.59 110.575 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -29.75 34.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.165 0.507 . . . . 15.98 110.597 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -89.05 134.1 34.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.803 -0.635 . . . . 15.96 110.059 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 55.9 t60 58.07 47.74 14.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.587 0.708 . . . . 14.95 109.819 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' -18' ' ' MET . 49.7 t-80 -96.79 -44.39 7.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.563 -0.744 . . . . 13.19 110.624 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -151.55 -64.48 0.18 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.094 -0.503 . . . . 12.27 109.682 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -176.02 75.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.724 -0.671 . . . . 10.26 110.011 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -89.49 -36.31 15.47 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.498 -0.556 . . . . 10.28 109.498 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 22.5 t -80.77 137.82 36.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.909 -0.587 . . . . 7.15 109.603 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 5.1 p -86.94 40.99 0.94 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.081 0.467 . . . . 6.15 111.17 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 89.99 -158.76 27.24 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.998 -0.62 . . . . 3.18 111.847 -178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.544 ' O ' ' HG ' ' A' ' -7' ' ' LEU . 2.5 pt? -150.8 93.4 1.94 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.588 0.708 . . . . 2.72 110.638 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -155.62 105.24 2.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.806 -0.634 . . . . 3.44 110.465 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.501 HG23 ' CD2' ' A' ' -3' ' ' PHE . 0.8 OUTLIER -153.75 96.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.466 0.65 . . . . 1.67 110.519 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . 0.514 HD21 ' H ' ' A' ' -4' ' ' LEU . 2.5 pt? -88.99 11.21 18.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.99 -0.55 . . . . 3.56 111.1 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.501 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.6 m-85 -85.63 26.98 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.095 0.474 . . . . 2.17 110.334 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -165.2 -72.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.012 -0.54 . . . . 3.2 109.67 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 125.73 -78.44 0.37 Allowed Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.061 -1.066 . . . . 1.77 114.655 172.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -59.33 174.64 0.96 Allowed 'Trans proline' 0 N--CA 1.479 0.637 0 C-N-CA 123.955 3.104 . . . . 2.71 116.016 -166.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -146.18 -179.49 6.77 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.759 -1.564 . . . . 6.04 108.531 176.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.405 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 56.4 ttt180 -156.64 22.05 0.34 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.044 -0.663 . . . . 3.6 112.077 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.26 -89.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.244 1.202 . . . . 1.31 114.244 173.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.57 60.72 0.52 Allowed Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.089 -0.577 . . . . 0.7 112.825 -170.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.605 HG21 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -104.09 -169.14 1.59 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 117.045 0.423 . . . . 1.09 110.59 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.605 ' H ' HG21 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 1.61 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.523 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 1.04 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.523 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.7 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 1.28 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 2.37 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 1.06 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.571 HG23 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 1.09 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.72 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.568 HG21 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 1.08 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 1.2 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.73 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 1.37 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.405 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.73 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.76 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.527 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 4.37 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.25 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.709 ' HB1' ' HH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 1.08 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 2.11 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.27 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.642 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.642 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.29 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 1.03 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.658 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 1.02 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.42 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 1.27 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 1.02 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.709 ' HH ' ' HB1' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 1.04 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.82 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.77 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.87 113.991 -160.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 2.35 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 1.25 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.533 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -82.27 115.66 59.07 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 4.01 110.659 -175.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.6 Cg_exo -57.06 117.61 4.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.474 1.449 . . . . 0.94 108.948 165.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 tp -150.94 -73.46 0.16 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.633 -0.712 . . . . 2.33 110.865 -166.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.582 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 19.0 p -139.47 -159.49 0.96 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.175 -0.466 . . . . 3.66 110.209 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.463 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 5.7 tpt -98.74 -154.07 0.45 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.203 -1.036 . . . . 6.7 108.203 176.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.463 ' H ' ' HG3' ' A' ' 46' ' ' MET . 88.7 mttt -83.94 -30.39 26.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.38 0.61 . . . . 10.87 109.548 174.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -126.76 84.17 2.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 10.51 109.59 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' A' ' 45' ' ' THR . 52.1 mm-40 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.173 -0.917 . . . . 7.0 111.234 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.977 0.418 . . . . 17.59 110.587 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -126.07 49.85 1.93 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.148 -0.478 . . . . 15.98 111.074 -177.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -58.98 109.44 0.83 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.513 . . . . 15.96 111.072 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.1 m80 57.54 25.45 11.56 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.742 -0.663 . . . . 14.95 111.316 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -103.45 21.04 16.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.647 0.737 . . . . 13.19 109.444 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -165.32 162.38 19.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.154 -0.93 . . . . 12.27 109.707 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -110.26 80.76 1.34 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.208 -0.664 . . . . 10.26 109.208 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -93.04 70.46 4.55 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.408 -0.815 . . . . 10.28 110.707 -172.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.9 m -64.83 -51.43 62.15 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.928 -0.767 . . . . 7.15 108.928 173.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 15.5 t -159.88 118.74 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.342 -0.844 . . . . 6.15 109.048 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -158.92 152.64 23.73 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.434 -0.666 . . . . 3.18 111.434 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.622 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -91.51 102.35 15.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.732 0.777 . . . . 2.72 112.103 -174.229 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -133.52 9.93 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.564 -0.744 . . . . 3.44 111.223 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.456 HG11 ' NE ' ' A' ' 19' ' ' ARG . 11.4 p -116.34 130.16 71.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.106 -0.331 . . . . 1.67 110.106 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 95.7 mt -131.53 33.66 4.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.983 0.421 . . . . 3.56 110.928 -178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -139.5 132.04 28.73 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.309 -0.405 . . . . 2.17 110.705 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 58.61 67.91 0.88 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.507 -0.769 . . . . 3.2 111.365 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . 0.404 ' HA3' ' HB3' ' A' ' 19' ' ' ARG . . . 167.78 116.48 0.36 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.696 -0.764 . . . . 1.77 113.024 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 67.7 Cg_endo -89.88 -146.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.118 2.545 . . . . 2.71 112.514 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.424 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 91.9 mtm180 -122.74 -163.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.68 -0.489 . . . . 6.04 109.68 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.526 ' HD2' ' OG1' ' A' ' 5' ' ' THR . 0.0 OUTLIER 179.44 -15.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.68 0.276 . . . . 3.6 110.558 -178.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.38 -94.08 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.618 0.97 . . . . 1.31 113.618 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.39 59.44 3.02 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.388 -0.434 . . . . 0.7 112.719 -172.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.664 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m -121.04 -176.84 3.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.368 0.584 . . . . 1.09 110.554 -176.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.547 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 1.61 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 1.04 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.577 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.2 t30 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.7 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.575 ' SG ' HD21 ' A' ' 44' ' ' LEU . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 1.28 112.275 -175.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 2.37 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 1.06 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 1.09 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.72 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.538 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 1.08 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 1.2 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.538 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 1.37 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.456 ' NE ' HG11 ' A' ' -5' ' ' VAL . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.76 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 4.37 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.25 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 1.08 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 2.11 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.27 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.613 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.613 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.29 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.562 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 1.03 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.664 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 1.02 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.562 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.42 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.759 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.795 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 1.27 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.463 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 1.02 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 1.04 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.759 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.82 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.795 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.77 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.87 114.084 -165.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 2.35 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 1.25 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.643 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -89.95 105.62 11.76 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 4.01 109.342 -174.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.643 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.1 Cg_exo -52.3 118.1 4.28 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 121.854 1.703 . . . . 0.94 110.121 176.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.575 HD21 ' SG ' ' A' ' 10' ' ' CYS . 3.9 tp -166.26 -71.5 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.284 -0.871 . . . . 2.33 109.706 -166.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER 50.76 -97.64 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.689 -1.141 . . . . 3.66 112.343 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.419 ' H ' ' HB ' ' A' ' 45' ' ' THR . 21.9 mmt -121.65 44.94 2.43 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.015 -0.539 . . . . 6.7 109.769 -177.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 70.81 -68.72 0.2 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.102 -0.953 . . . . 10.87 111.479 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -144.69 80.4 1.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.817 0.342 . . . . 10.51 111.307 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.645 -0.693 . . . . 7.0 109.984 172.466 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.096 0.474 . . . . 17.59 110.213 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -77.86 -11.06 59.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.153 -0.476 . . . . 15.98 111.849 -175.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -104.85 13.98 30.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.144 0.497 . . . . 15.96 110.84 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -139.6 115.96 10.56 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.319 -0.623 . . . . 14.95 109.319 175.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -118.05 8.3 12.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.753 0.311 . . . . 13.19 111.51 -174.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -142.9 109.41 5.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.392 0.615 . . . . 12.27 110.286 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -79.76 -77.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.403 -0.817 . . . . 10.26 110.751 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 67.0 150.66 0.06 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.614 0.721 . . . . 10.28 111.605 -177.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 17.3 m -86.03 51.74 2.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 7.15 110.806 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 37.9 m -138.6 33.01 2.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.75 -0.659 . . . . 6.15 109.894 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -92.52 -130.97 5.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.477 -0.783 . . . . 3.18 111.157 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.572 HD12 ' H ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -80.21 43.31 0.62 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.575 0.702 . . . . 2.72 110.872 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -88.9 -13.15 39.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.133 -0.94 . . . . 3.44 111.239 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.468 ' HB ' HD12 ' A' ' 33' ' ' LEU . 5.4 p -72.13 100.45 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.622 0.725 . . . . 1.67 110.457 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 24.2 tp -142.27 73.2 1.4 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.439 0.638 . . . . 3.56 110.223 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.54 -33.65 0.3 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.328 -0.851 . . . . 2.17 110.554 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.408 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 13.0 mm-40 -140.97 83.25 1.88 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 3.2 110.681 178.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 151.61 131.35 1.75 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 120.698 -0.763 . . . . 1.77 113.047 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.46 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 43.6 Cg_endo -92.2 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 123.491 2.794 . . . . 2.71 112.86 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.46 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 95.7 mtt180 -130.95 -163.3 1.3 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.692 -0.484 . . . . 6.04 109.692 175.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -176.33 14.45 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.73 0.3 . . . . 3.6 111.717 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.89 -95.74 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.316 1.228 . . . . 1.31 114.316 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.12 57.23 0.6 Allowed Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.943 -0.646 . . . . 0.7 112.91 -170.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -97.07 -168.65 1.73 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.74 -0.271 . . . . 1.09 111.036 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.581 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 1.61 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 1.04 113.803 178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.7 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.416 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 1.28 111.337 -171.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 2.37 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 1.06 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.575 HG21 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 1.09 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.72 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 1.08 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 1.2 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.554 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 1.37 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.76 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 4.37 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.25 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.615 ' HB3' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 1.08 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 2.11 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.27 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.592 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.29 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 1.03 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.455 ' CA ' HG23 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 1.02 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.512 ' SG ' HD12 ' A' ' 44' ' ' LEU . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.42 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.719 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.718 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 1.27 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.469 ' CE2' ' HD2' ' A' ' 38' ' ' HIS . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 1.02 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.615 ' OH ' ' HB3' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 1.04 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.719 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.82 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.77 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.469 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 50.0 m-70 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.87 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 2.35 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 1.25 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.611 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.705 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.7 tmt_? -85.77 109.47 22.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 4.01 109.151 -174.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.611 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.79 118.93 5.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.011 1.808 . . . . 0.94 110.932 173.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.705 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 11.8 mt -121.69 -158.18 0.76 Allowed 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 109.143 -0.688 . . . . 2.33 109.143 -173.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.668 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 16.7 p -139.45 -157.76 0.8 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.9 -0.591 . . . . 3.66 110.27 -174.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 35.6 mtm -90.59 -163.3 1.0 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.901 -0.777 . . . . 6.7 108.901 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -70.93 -45.81 63.58 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.832 -0.803 . . . . 10.87 108.832 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.521 ' HB3' ' HZ2' ' A' ' 48' ' ' LYS . 4.2 mmmp? -92.01 49.92 1.6 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.536 -0.756 . . . . 10.51 111.046 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.668 ' O ' ' HB ' ' A' ' 45' ' ' THR . 44.3 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.338 -0.839 . . . . 7.0 111.72 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 90.9 mmm . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.76 0.314 . . . . 17.59 110.509 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -153.62 51.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.115 0.483 . . . . 15.98 110.076 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.92 66.3 4.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.013 -0.539 . . . . 15.96 110.484 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -118.42 21.78 12.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.351 0.596 . . . . 14.95 109.666 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 60.6 t60 -145.78 92.46 2.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.168 -0.924 . . . . 13.19 109.268 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -62.37 144.62 55.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.949 0.404 . . . . 12.27 110.74 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -119.31 119.27 33.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.182 -0.463 . . . . 10.26 110.17 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -79.41 75.49 6.01 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.774 -0.648 . . . . 10.28 110.049 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 37.6 m -84.85 103.13 13.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.876 -0.602 . . . . 7.15 110.619 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 24.7 m -131.08 61.4 1.64 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.037 -0.529 . . . . 6.15 110.244 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -71.92 -20.96 79.13 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.743 -0.662 . . . . 3.18 112.317 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.548 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 67.6 mt 67.19 71.35 0.36 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.11 0.564 . . . . 2.72 110.803 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -162.54 143.97 10.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 3.44 110.315 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.506 HG23 ' HG ' ' A' ' 33' ' ' LEU . 4.0 p -127.07 -12.97 3.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.499 -0.319 . . . . 1.67 110.4 177.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 75.52 -64.38 0.37 Allowed 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.335 0.654 . . . . 3.56 112.209 176.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.474 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 18.8 p90 -89.31 58.43 4.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.64 0.607 . . . . 2.17 112.64 -171.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.483 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 54.3 tp60 -177.96 120.8 0.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 3.2 109.396 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -76.53 123.78 6.88 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 121.005 -0.617 . . . . 1.77 113.342 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -95.51 156.36 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.532 2.821 . . . . 2.71 112.608 175.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.4 ' O ' ' HB2' ' A' ' 2' ' ' ARG . 52.9 ttp180 -173.48 96.13 0.11 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.649 -0.251 . . . . 6.04 111.225 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.448 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 2.1 mtt180 164.7 156.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 3.6 108.781 177.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.71 -62.97 0.8 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.231 0.456 . . . . 1.31 112.231 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.25 56.59 3.2 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.936 -0.65 . . . . 0.7 112.106 -177.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.57 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m -119.96 -177.64 3.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.346 -0.502 . . . . 1.09 111.148 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.57 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 1.61 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.507 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 1.04 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.507 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.7 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 1.28 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 2.37 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 1.06 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 1.09 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.72 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.615 HG21 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 1.08 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 1.2 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.615 ' H ' HG21 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 1.37 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.414 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.593 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.76 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 4.37 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.25 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 1.08 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 2.11 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.27 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.498 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.498 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.29 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 1.03 109.293 178.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.407 ' CA ' HG22 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.548 ' OD1' ' HA ' ' A' ' -7' ' ' LEU . 0.7 OUTLIER -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 1.02 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.42 111.661 -175.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 1.27 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.702 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 1.02 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 1.04 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.82 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.77 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.87 114.601 -161.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 2.35 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 1.25 109.914 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.688 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.702 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 -94.04 105.0 14.97 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 4.01 110.414 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.688 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.2 Cg_exo -62.47 119.43 6.52 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.314 2.009 . . . . 0.94 112.03 174.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.592 ' CD2' ' HG3' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -127.07 -96.05 0.43 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.212 -0.903 . . . . 2.33 110.499 177.426 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.3 m 67.82 -83.75 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.804 -1.089 . . . . 3.66 111.323 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.4 tpt -149.75 -66.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.073 0.463 . . . . 6.7 111.372 -179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 62.9 tttm -151.65 59.98 0.87 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.629 -0.714 . . . . 10.87 110.681 -174.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 43.87 49.08 7.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.613 0.968 . . . . 10.51 113.613 -177.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 47' ' ' LYS . 52.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 109.185 -0.672 . . . . 7.0 109.185 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 109.719 -0.474 . . . . 17.59 109.719 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -130.33 18.77 5.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.881 0.372 . . . . 15.98 111.296 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -82.2 107.65 15.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.892 0.377 . . . . 15.96 110.815 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -139.91 150.13 44.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.697 -0.683 . . . . 14.95 109.552 171.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . 0.463 ' O ' ' HB2' ' A' ' -13' ' ' HIS . 39.2 m80 71.4 126.02 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 O-C-N 124.127 0.892 . . . . 13.19 110.389 -176.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . 0.463 ' HB2' ' O ' ' A' ' -14' ' ' HIS . 52.5 m-70 71.77 117.06 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.626 -0.715 . . . . 12.27 111.525 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -99.51 155.17 17.71 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.924 -0.58 . . . . 10.26 110.023 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -77.3 72.69 3.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.084 0.469 . . . . 10.28 110.393 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.7 p -80.69 60.52 4.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.481 0.658 . . . . 7.15 110.379 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 41.3 m -145.5 133.09 20.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.55 -0.75 . . . . 6.15 110.174 -178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 171.07 -56.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 110.728 -0.949 . . . . 3.18 110.728 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' -7' ' ' LEU . 1.1 mp -92.69 79.71 4.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.834 -1.173 . . . . 2.72 107.834 174.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.75 -83.27 0.4 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.987 -0.552 . . . . 3.44 111.686 -173.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.532 ' HB ' HD12 ' A' ' 33' ' ' LEU . 3.9 p 37.91 60.44 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 122.467 1.127 . . . . 1.67 110.653 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.09 43.4 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.165 -0.925 . . . . 3.56 113.086 -169.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.533 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 9.0 p90 -143.4 41.65 1.48 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.509 0.671 . . . . 2.17 110.368 177.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.624 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 7.5 tp-100 -172.34 160.09 4.87 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.073 -0.967 . . . . 3.2 108.857 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . 0.465 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . -41.34 127.11 3.57 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 123.825 0.703 . . . . 1.77 113.607 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.465 ' HD3' ' HA2' ' A' ' -1' ' ' GLY . 24.1 Cg_exo -63.32 -75.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.232 2.621 . . . . 2.71 114.212 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.496 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 6.5 ppt_? -150.7 -174.73 4.86 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 112.373 0.509 . . . . 6.04 112.373 -173.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.75 17.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.267 -0.424 . . . . 3.6 110.859 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.55 -106.12 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.952 0.723 . . . . 1.31 112.952 175.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.96 74.24 0.25 Allowed Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.107 -1.044 . . . . 0.7 112.184 -174.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.713 ' O ' HG23 ' A' ' 13' ' ' THR . 0.7 OUTLIER -110.01 -172.68 2.09 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.818 -0.691 . . . . 1.09 109.926 -178.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.533 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 1.61 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 1.04 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.0 t30 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.7 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.555 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 1.28 112.513 -175.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.611 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 2.37 113.529 -172.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 1.06 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.713 HG23 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 1.09 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.72 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.505 HG21 ' H ' ' A' ' 17' ' ' LEU . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 1.08 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 1.2 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.584 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 1.37 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.496 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.624 ' NH1' ' HB3' ' A' ' -2' ' ' GLN . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.76 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 4.37 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.25 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 1.08 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 2.11 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.504 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.27 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.505 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.505 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.29 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.561 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 1.03 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.439 ' CA ' HG22 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.417 ' H ' HG22 ' A' ' 15' ' ' THR . 1.5 t-20 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 1.02 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.561 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.42 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.589 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.814 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 1.27 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.594 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 1.02 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 1.04 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.82 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.814 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.77 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.418 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 64.4 m-70 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.87 114.436 -166.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 2.35 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 1.25 109.768 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.62 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.594 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER -93.84 104.55 13.39 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 4.01 109.062 -174.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.2 Cg_exo -53.42 117.64 4.02 Favored 'Trans proline' 0 CA--C 1.511 -0.638 0 C-N-CA 121.622 1.548 . . . . 0.94 109.628 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.555 HD23 ' SG ' ' A' ' 10' ' ' CYS . 7.3 tp -153.33 -71.92 0.14 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.606 -0.725 . . . . 2.33 110.845 -166.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.9 p -134.8 -104.8 0.23 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.052 -0.522 . . . . 3.66 110.776 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 40.7 tpp -167.73 158.74 11.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.648 -0.871 . . . . 6.7 108.648 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 25.5 ttpp -47.91 -50.45 26.74 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.512 0.507 . . . . 10.87 110.547 -178.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -134.24 85.48 2.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.488 . . . . 10.51 109.861 173.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.417 -0.801 . . . . 7.0 110.076 179.54 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.871 0.367 . . . . 17.59 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.18 -74.56 0.2 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.909 -0.587 . . . . 15.98 110.397 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 45.9 m80 51.9 55.99 8.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.985 -0.552 . . . . 15.96 111.491 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -123.22 156.09 35.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.965 -0.562 . . . . 14.95 109.905 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 63.95 -87.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.587 0.554 . . . . 13.19 110.975 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 16.2 m-70 51.79 55.94 8.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.347 0.594 . . . . 12.27 111.62 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -93.59 75.21 4.39 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.647 -0.706 . . . . 10.26 109.67 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -76.87 -31.91 57.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 10.28 110.199 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 14.5 m -66.46 129.11 38.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 7.15 110.726 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 19.9 m -69.51 135.96 50.79 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.493 -0.558 . . . . 6.15 109.493 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -84.82 156.04 30.99 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.734 -0.746 . . . . 3.18 112.636 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.502 ' H ' HD22 ' A' ' -7' ' ' LEU . 0.2 OUTLIER -74.74 78.91 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.357 0.598 . . . . 2.72 109.895 178.453 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -131.22 55.71 1.84 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.239 -0.891 . . . . 3.44 110.453 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.54 ' O ' HG21 ' A' ' -5' ' ' VAL . 5.0 p -141.75 50.28 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.702 1.239 . . . . 1.67 109.2 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -80.58 3.16 22.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.881 -1.054 . . . . 3.56 111.908 -173.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -83.91 -12.48 55.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.655 -0.248 . . . . 2.17 111.237 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -162.56 113.5 1.53 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.539 0.209 . . . . 3.2 111.411 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 128.5 139.81 4.84 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.689 -0.767 . . . . 1.77 113.314 175.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 66.0 Cg_endo -92.47 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.339 2.693 . . . . 2.71 112.645 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -138.0 165.61 26.14 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.233 -0.654 . . . . 6.04 109.233 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -151.37 21.76 0.73 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.574 -0.45 . . . . 3.6 111.592 -172.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.83 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.249 1.203 . . . . 1.31 114.249 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -122.96 53.03 0.75 Allowed Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.001 -0.619 . . . . 0.7 113.285 -169.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.589 HG23 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -89.07 -169.19 2.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.35 -0.241 . . . . 1.09 110.35 177.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.589 ' H ' HG23 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 1.61 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 1.04 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.4 t30 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.7 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.449 ' SG ' HD23 ' A' ' 44' ' ' LEU . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 1.28 112.131 -175.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 2.37 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 10' ' ' CYS . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 1.06 109.271 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 1.09 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.497 ' O ' HG21 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.72 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.499 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 1.08 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 1.2 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 1.37 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.76 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 4.37 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.25 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' HB2' ' HH ' ' A' ' 35' ' ' TYR . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 1.08 113.349 -173.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 2.11 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.27 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.474 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.29 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 1.03 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.565 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 1.02 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.698 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.42 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.717 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.669 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 1.27 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 1.02 111.414 -173.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.444 ' HH ' ' HB2' ' A' ' 22' ' ' ALA . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 1.04 110.558 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.717 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.82 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.77 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.462 ' O ' HG21 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.87 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 2.35 111.972 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 1.25 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.578 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.698 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 -90.7 110.43 41.44 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 4.01 110.433 -174.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.578 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.9 Cg_exo -56.43 116.9 3.52 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.553 1.502 . . . . 0.94 109.199 169.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.449 HD23 ' SG ' ' A' ' 10' ' ' CYS . 3.0 tp -153.36 -85.25 0.07 Allowed 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.747 -0.66 . . . . 2.33 110.518 -168.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 38.83 -101.11 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.197 0.936 . . . . 3.66 112.474 -178.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 36.8 tpp -116.27 166.35 12.14 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.962 -0.755 . . . . 6.7 108.962 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -46.58 -42.49 16.09 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.289 0.368 . . . . 10.87 111.441 -176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -133.68 75.93 1.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.226 0.536 . . . . 10.51 110.388 172.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.684 -0.674 . . . . 7.0 109.19 176.056 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.6 mpp? . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.329 -0.249 . . . . 17.59 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.34 57.42 4.45 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.726 0.641 . . . . 15.98 111.954 177.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 66.2 m80 59.57 48.55 9.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.816 -0.629 . . . . 15.96 111.353 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -83.65 71.61 10.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.994 0.426 . . . . 14.95 110.201 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.98 132.3 46.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 13.19 110.257 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -81.3 133.35 35.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.157 -0.474 . . . . 12.27 110.948 -175.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -97.34 93.34 6.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 10.26 110.185 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -87.7 54.63 3.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.395 0.617 . . . . 10.28 109.97 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 20.4 m -82.71 75.32 9.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.842 -0.617 . . . . 7.15 110.219 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.4 m -84.33 10.27 11.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.694 -0.684 . . . . 6.15 110.58 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 113.08 -4.63 25.49 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.969 -0.852 . . . . 3.18 110.969 -174.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.52 ' HB2' HD23 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -162.93 146.81 11.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.204 -0.498 . . . . 2.72 110.477 178.003 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -143.65 -61.29 0.4 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.418 -0.355 . . . . 3.44 111.18 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.517 ' HB ' HD11 ' A' ' 33' ' ' LEU . 2.7 p -53.92 104.4 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.454 0.645 . . . . 1.67 112.07 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 2.1 pp -127.75 6.89 6.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.167 0.508 . . . . 3.56 110.774 177.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -88.14 -15.95 34.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 2.17 111.33 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -155.52 91.46 1.32 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.577 -0.283 . . . . 3.2 110.538 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 145.19 132.09 2.43 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.679 -0.772 . . . . 1.77 112.948 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 47.0 Cg_endo -89.68 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.633 2.889 . . . . 2.71 112.507 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.428 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 42.1 ttm180 -134.63 150.77 50.7 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 110.189 -0.3 . . . . 6.04 110.189 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.492 ' HB3' ' OG1' ' A' ' 5' ' ' THR . 25.9 mmt180 -116.85 -17.55 10.42 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.321 -0.399 . . . . 3.6 110.657 -178.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.22 -111.56 0.06 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.62 0.768 . . . . 1.31 112.333 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.61 60.03 4.89 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 121.348 -0.453 . . . . 0.7 112.5 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 6' ' ' CYS . 4.7 m -120.76 -179.54 4.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 117.122 0.461 . . . . 1.09 110.586 -174.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.553 ' H ' HG23 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 1.61 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.488 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 1.04 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.488 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.7 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 1.28 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 2.37 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 1.06 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.537 HG21 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 1.09 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.528 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.72 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 1.08 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 1.2 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.555 ' H ' HG23 ' A' ' 15' ' ' THR . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 1.37 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.479 ' CG ' ' HB2' ' A' ' 2' ' ' ARG . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.76 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 4.37 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.25 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 1.08 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 2.11 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.477 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.27 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.627 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.29 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 1.03 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.457 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 1.02 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.425 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.42 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.683 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.673 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 1.27 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 1.02 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 1.04 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.627 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.82 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.673 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.77 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.87 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 2.35 112.202 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 1.25 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.656 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.527 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.53 97.38 16.53 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 4.01 110.772 -167.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.5 Cg_exo -63.17 118.93 5.83 Favored 'Trans proline' 0 CA--C 1.507 -0.872 0 C-N-CA 122.604 2.203 . . . . 0.94 109.663 173.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.0 tp -165.57 -72.53 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 120.104 -0.638 . . . . 2.33 112.187 -165.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.471 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 5.2 p -146.14 -152.83 0.45 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.835 -0.62 . . . . 3.66 110.242 -174.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.459 ' H ' ' HB ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -95.54 -162.7 0.97 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.126 -0.694 . . . . 6.7 109.126 175.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -68.06 -28.34 67.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.161 0.505 . . . . 10.87 109.982 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -149.81 93.78 2.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.399 -0.818 . . . . 10.51 109.898 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' A' ' 45' ' ' THR . 4.0 mp0 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.41 -0.805 . . . . 7.0 110.739 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.0 ptm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.7 0.286 . . . . 17.59 110.333 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.14 114.68 6.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.173 -0.467 . . . . 15.98 110.114 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -76.49 113.05 13.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.301 -0.409 . . . . 15.96 110.032 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -88.75 93.99 9.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.984 -0.376 . . . . 14.95 109.984 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -58.13 132.87 54.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 13.19 110.325 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -81.16 117.75 21.98 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.968 -0.56 . . . . 12.27 110.889 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' -9' ' ' SER . 39.8 m-70 -74.48 -1.44 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.693 -0.685 . . . . 10.26 111.096 -176.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -64.32 -30.02 71.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.268 0.556 . . . . 10.28 109.522 170.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.2 m -93.48 47.43 1.24 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.738 -0.664 . . . . 7.15 109.827 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -9' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' -12' ' ' HIS . 13.5 t -86.5 -50.17 7.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.897 -0.592 . . . . 6.15 109.985 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -104.71 163.56 14.61 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.536 -0.84 . . . . 3.18 111.717 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.465 ' CD1' ' HB ' ' A' ' 16' ' ' THR . 10.3 mp -86.04 41.45 0.92 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.869 0.366 . . . . 2.72 110.964 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' -5' ' ' VAL . 6.7 tp10 61.55 -172.66 0.14 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.816 -0.629 . . . . 3.44 110.499 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.518 ' H ' ' HG3' ' A' ' -6' ' ' GLU . 14.2 p 46.52 34.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 122.182 0.991 . . . . 1.67 111.676 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -82.01 83.89 7.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.516 -0.765 . . . . 3.56 110.815 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -164.16 -41.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 2.17 111.32 176.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -134.55 90.64 2.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.209 -0.196 . . . . 3.2 110.59 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 155.0 139.34 2.77 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.448 -0.882 . . . . 1.77 113.032 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -87.7 -159.89 0.1 OUTLIER 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.424 2.749 . . . . 2.71 112.638 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -142.26 168.05 20.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.592 . . . . 6.04 109.719 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.2 ttt-85 -158.89 176.11 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.858 -0.793 . . . . 3.6 108.858 -175.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.38 165.51 27.21 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.529 -0.468 . . . . 1.31 110.348 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.86 40.04 56.74 Favored Glycine 0 C--N 1.35 1.321 0 C-N-CA 121.099 -0.572 . . . . 0.7 113.108 -175.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m -121.06 170.56 9.41 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.822 0.311 . . . . 1.09 111.116 -173.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.431 ' H ' HG21 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 1.61 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 1.04 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.7 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.506 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 1.28 112.308 -173.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 2.37 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 1.06 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 1.09 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.475 ' O ' HG23 ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.72 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 1.08 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.465 ' HB ' ' CD1' ' A' ' -7' ' ' LEU . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 1.2 111.584 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.577 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 1.37 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.489 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.76 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 4.37 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.25 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 1.08 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 2.11 108.196 -173.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.514 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.27 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.29 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 1.03 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.452 ' CA ' HG23 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.492 ' H ' HG23 ' A' ' 15' ' ' THR . 0.9 OUTLIER -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 1.02 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.527 ' SG ' HD11 ' A' ' 44' ' ' LEU . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.42 111.614 -173.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.569 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.468 HD12 ' HB ' ' A' ' -5' ' ' VAL . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 1.27 109.585 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 1.02 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 1.04 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.82 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.77 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.87 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 2.35 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 1.25 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.53 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.565 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 tpt180 -82.99 115.61 59.78 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 4.01 110.154 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.53 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 60.6 Cg_exo -57.61 125.68 19.48 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.877 1.718 . . . . 0.94 110.747 168.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 6.4 mt -133.63 -144.02 0.22 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.537 -0.756 . . . . 2.33 109.174 -173.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 39.5 m 75.66 -55.31 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.754 0.659 . . . . 3.66 111.85 175.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 51.5 tpp -164.57 -62.57 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.405 -0.816 . . . . 6.7 110.497 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -167.95 48.24 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.659 -1.155 . . . . 10.87 109.427 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? 58.69 82.72 0.13 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.835 -0.62 . . . . 10.51 109.549 -171.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.616 -0.707 . . . . 7.0 110.146 -179.575 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.836 0.35 . . . . 17.59 110.633 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -96.63 48.42 1.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.955 0.407 . . . . 15.98 111.012 -178.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -138.5 143.98 39.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.151 -0.477 . . . . 15.96 109.76 177.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -113.39 63.69 0.64 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.676 0.75 . . . . 14.95 111.045 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -121.15 55.61 1.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.172 -0.922 . . . . 13.19 109.64 174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -91.35 -36.88 13.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.954 -0.566 . . . . 12.27 110.215 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -84.57 -38.66 19.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.708 -0.678 . . . . 10.26 109.667 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -89.99 103.86 16.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.757 -0.656 . . . . 10.28 109.946 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 30.6 m 66.61 -170.91 0.19 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.732 0.645 . . . . 7.15 110.587 -177.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 18.1 m 73.23 -53.73 0.7 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.339 0.655 . . . . 6.15 111.93 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -61.47 -24.46 63.87 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 121.587 -0.339 . . . . 3.18 113.411 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.5 HD21 ' H ' ' A' ' -7' ' ' LEU . 2.5 pt? -78.26 50.7 0.94 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.505 0.669 . . . . 2.72 111.062 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.04 -11.62 59.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.466 -0.788 . . . . 3.44 111.213 -175.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.439 ' O ' HG11 ' A' ' -5' ' ' VAL . 7.4 p -76.02 85.0 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 122.059 0.933 . . . . 1.67 110.471 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.5 pp -95.81 21.98 7.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.703 -0.68 . . . . 3.56 111.46 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -129.83 146.85 51.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.464 -0.334 . . . . 2.17 111.102 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 53.89 68.79 0.79 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.802 -0.636 . . . . 3.2 111.908 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 170.88 140.31 2.99 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.182 -1.009 . . . . 1.77 113.498 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.04 -158.05 0.08 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 123.367 2.711 . . . . 2.71 112.007 175.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 -146.32 168.2 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.826 -0.435 . . . . 6.04 109.826 178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.506 ' HG3' ' H ' ' A' ' 3' ' ' ALA . 11.8 tpp180 -164.74 177.67 7.81 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.278 -1.008 . . . . 3.6 108.278 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.506 ' H ' ' HG3' ' A' ' 2' ' ' ARG . . . -144.62 165.89 26.75 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.309 -0.626 . . . . 1.31 109.309 171.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.37 43.64 51.95 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 120.584 -0.817 . . . . 0.7 112.401 -174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.42 ' O ' HG21 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.88 177.82 4.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.865 0.333 . . . . 1.09 110.635 -175.144 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 1.61 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 1.04 113.4 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.7 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.483 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 1.28 111.775 -172.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 2.37 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 1.06 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.42 HG21 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 1.09 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.521 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.72 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.578 HG21 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 1.08 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 1.2 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.578 ' H ' HG21 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 1.37 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.76 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 4.37 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.25 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 1.08 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 2.11 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.513 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.27 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.532 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.29 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 1.03 109.09 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.412 ' CA ' HG22 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 1.02 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.618 ' SG ' HD13 ' A' ' 44' ' ' LEU . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.42 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 1.27 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.414 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 1.02 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 1.04 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.82 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.77 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.87 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 2.35 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 1.25 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.602 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.666 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.0 tmt_? -81.02 110.72 18.89 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 4.01 109.192 -173.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.602 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.93 119.06 5.87 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 121.947 1.764 . . . . 0.94 111.07 174.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 7.5 mt -124.81 -143.49 0.31 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.032 -0.531 . . . . 2.33 109.792 -173.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.586 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.86 -138.41 0.2 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.672 -0.862 . . . . 3.66 108.672 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.429 ' H ' ' HB ' ' A' ' 45' ' ' THR . 65.1 mtm -91.1 -179.62 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 118.066 0.394 . . . . 6.7 110.382 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.27 -40.76 82.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.36 -0.607 . . . . 10.87 109.36 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -122.61 71.02 1.01 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.622 -0.717 . . . . 10.51 110.579 173.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.586 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 27.8 mt-10 . . . . . 0 C--O 1.252 1.233 0 CA-C-O 118.705 -0.664 . . . . 7.0 111.491 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 111.529 0.196 . . . . 17.59 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -93.04 25.35 3.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.925 0.343 . . . . 15.98 111.925 -175.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -116.71 27.36 9.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.886 0.374 . . . . 15.96 110.358 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -84.69 143.33 29.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 14.95 110.861 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -159.23 124.84 4.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.779 -0.646 . . . . 13.19 109.874 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -85.28 74.29 10.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.148 -0.478 . . . . 12.27 111.305 -176.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -87.89 136.54 32.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.962 -0.755 . . . . 10.26 108.962 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -78.06 72.52 4.6 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.177 0.513 . . . . 10.28 110.96 -175.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 38.7 m -137.86 40.51 2.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.825 -0.625 . . . . 7.15 110.483 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 32.0 t -127.5 102.33 6.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.989 0.423 . . . . 6.15 111.318 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 76.39 72.29 1.11 Allowed Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.818 -0.628 . . . . 3.18 113.524 173.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.525 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 3.1 mp -122.29 57.7 1.07 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 2.72 110.699 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -149.86 89.36 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.701 -0.681 . . . . 3.44 110.67 172.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.546 ' HB ' ' CD1' ' A' ' 33' ' ' LEU . 6.2 p -136.17 119.95 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.852 -0.796 . . . . 1.67 108.852 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.3 tt -90.31 -50.59 5.89 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.904 0.383 . . . . 3.56 110.852 -172.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.15 136.03 46.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.467 0.543 . . . . 2.17 112.467 -172.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 59.73 71.81 0.56 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 114.906 -1.043 . . . . 3.2 112.99 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . 0.424 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . 165.58 115.87 0.34 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 119.903 -1.141 . . . . 1.77 113.69 177.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.405 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 68.0 Cg_endo -88.91 -151.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.323 2.682 . . . . 2.71 112.64 175.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.405 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 42.7 mtm180 -124.57 -174.06 2.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.332 -0.395 . . . . 6.04 110.053 177.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -169.02 21.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.086 0.47 . . . . 3.6 110.936 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.91 -100.35 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.017 1.117 . . . . 1.31 114.017 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.42 61.95 0.37 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.102 -0.571 . . . . 0.7 113.028 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.595 HG21 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -100.48 -169.64 1.75 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.202 0.501 . . . . 1.09 110.634 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.595 ' H ' HG21 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 1.61 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.591 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 1.04 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.591 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.8 t30 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.7 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.603 ' SG ' HD21 ' A' ' 44' ' ' LEU . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 1.28 111.953 -175.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 47' ' ' LYS . 1.1 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 2.37 113.772 -171.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 10' ' ' CYS . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 1.06 108.911 171.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 1.09 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.613 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.72 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 1.08 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 1.2 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.536 ' H ' HG21 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 1.37 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.76 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.702 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 4.37 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.25 109.042 171.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' HB2' ' HH ' ' A' ' 35' ' ' TYR . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 1.08 113.99 -171.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 2.11 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.523 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.27 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.702 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.29 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 1.03 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.56 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 1.02 113.416 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.42 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.722 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.685 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 1.27 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 1.02 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HH ' ' HB2' ' A' ' 22' ' ' ALA . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 1.04 111.383 178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.82 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.77 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.87 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m120 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 2.35 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 1.25 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.581 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -88.42 110.02 33.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 4.01 110.872 -173.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.581 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.5 Cg_exo -55.5 117.76 4.42 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.431 1.421 . . . . 0.94 109.308 172.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.603 HD21 ' SG ' ' A' ' 10' ' ' CYS . 8.2 tp -156.51 -73.54 0.1 Allowed 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.983 -0.553 . . . . 2.33 111.248 -165.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -140.86 -155.55 0.6 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.996 -0.547 . . . . 3.66 109.763 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.461 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 28.6 tpp -136.56 -142.38 0.17 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.113 0.415 . . . . 6.7 109.992 -178.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.461 ' H ' ' HG3' ' A' ' 46' ' ' MET . 76.7 tttt -83.17 58.03 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.834 0.35 . . . . 10.87 110.397 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 54.54 85.69 0.06 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.576 -0.738 . . . . 10.51 110.913 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.353 -0.832 . . . . 7.0 110.263 -177.933 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.883 -0.043 . . . . 17.59 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.69 84.44 0.1 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.547 0.529 . . . . 15.98 110.452 -176.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.7 m80 62.01 -156.05 0.34 Allowed 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.08 -0.711 . . . . 15.96 109.08 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 70.3 m80 61.67 40.69 12.95 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.115 0.484 . . . . 14.95 110.147 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -75.87 97.13 3.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.876 -0.602 . . . . 13.19 111.192 -177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -65.87 115.76 6.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.081 -0.711 . . . . 12.27 109.081 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -65.38 101.15 0.54 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.139 0.495 . . . . 10.26 111.132 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -105.28 136.03 45.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.712 -0.676 . . . . 10.28 110.22 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 8.6 t 65.03 -171.32 0.19 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.688 0.617 . . . . 7.15 110.015 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 24.1 m 56.38 55.42 6.61 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.064 0.459 . . . . 6.15 110.674 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -75.73 -11.37 84.57 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 121.009 -0.615 . . . . 3.18 112.997 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . . . . . . . . . 14.9 mt -122.72 78.39 1.53 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.84 -0.43 . . . . 2.72 109.84 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -113.47 -83.6 0.6 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.916 -0.314 . . . . 3.44 111.752 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.486 ' HB ' HD11 ' A' ' 33' ' ' LEU . 7.3 p 38.7 56.55 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-O 122.285 1.04 . . . . 1.67 111.89 178.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 46.0 tp -87.07 60.62 6.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.156 -0.929 . . . . 3.56 110.686 -175.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -160.52 33.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.069 -0.514 . . . . 2.17 111.225 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -139.53 -57.35 0.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 3.2 111.384 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 175.57 -178.41 47.16 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.284 -0.96 . . . . 1.77 113.056 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.06 -148.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.383 2.722 . . . . 2.71 112.897 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -114.4 -164.6 0.94 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.277 -0.268 . . . . 6.04 110.277 177.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.433 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 65.2 ttt180 -151.12 34.32 0.58 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.491 0.662 . . . . 3.6 110.026 -177.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.79 -104.16 0.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.338 0.866 . . . . 1.31 113.338 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.59 52.83 0.77 Allowed Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.967 -0.635 . . . . 0.7 112.905 -172.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 13' ' ' THR . 1.3 m -80.75 -169.36 2.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.582 0.191 . . . . 1.09 111.09 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.59 ' H ' HG21 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 1.61 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.596 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 1.04 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.596 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.6 t30 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.7 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.587 ' SG ' HD22 ' A' ' 44' ' ' LEU . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 1.28 112.188 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 2.37 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 1.06 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.608 HG23 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 1.09 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.72 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.451 HG21 ' CA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 1.08 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 1.2 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.652 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 1.37 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.433 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.68 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.76 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 4.37 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.405 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.25 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.407 ' HB3' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 1.08 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 2.11 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.531 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.27 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.708 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.29 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 1.03 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.451 ' CA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.599 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.1 OUTLIER -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 1.02 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.54 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.42 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.589 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 1.27 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 1.02 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 1.04 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.82 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.77 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.418 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.87 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 2.35 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 1.25 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.627 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.54 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -89.62 107.99 22.26 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 4.01 109.777 -172.601 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.627 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.8 Cg_exo -55.09 116.88 3.45 Favored 'Trans proline' 0 CA--C 1.509 -0.733 0 C-N-CA 121.687 1.592 . . . . 0.94 109.303 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.587 HD22 ' SG ' ' A' ' 10' ' ' CYS . 10.6 tp -162.24 -69.85 0.05 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.896 -0.593 . . . . 2.33 111.178 -164.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.9 p -142.33 -156.95 0.73 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.417 -0.81 . . . . 3.66 108.907 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.8 tpt -140.37 155.77 46.65 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 6.7 109.817 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -42.44 -49.11 5.28 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.953 0.783 . . . . 10.87 111.435 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -131.95 72.95 1.51 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.506 -0.316 . . . . 10.51 110.794 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 116.06 -0.518 . . . . 7.0 111.721 173.28 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 46.0 tpp . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.629 0.252 . . . . 17.59 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -70.4 97.2 1.23 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.944 0.402 . . . . 15.98 111.897 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -109.46 -39.25 5.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.179 -0.464 . . . . 15.96 110.587 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -112.94 59.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.355 -0.384 . . . . 14.95 109.992 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 63.3 m80 62.91 -110.34 0.33 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.91 -0.587 . . . . 13.19 110.254 -173.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 64.92 -71.59 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.058 0.543 . . . . 12.27 111.171 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -91.24 126.08 36.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.253 -0.43 . . . . 10.26 109.918 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -82.52 80.62 8.61 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.414 -0.588 . . . . 10.28 109.414 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 5.8 m -78.52 89.9 4.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.602 -0.726 . . . . 7.15 109.903 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 62.9 m -56.44 95.23 0.02 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.609 0.568 . . . . 6.15 111.617 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' A' ' -7' ' ' LEU . . . -90.99 68.65 2.24 Favored Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 110.327 -1.109 . . . . 3.18 110.327 174.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.477 ' HB3' ' O ' ' A' ' -8' ' ' GLY . 0.3 OUTLIER 78.64 119.49 0.05 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.039 0.923 . . . . 2.72 110.34 -174.23 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . 0.548 ' HG2' ' H ' ' A' ' -5' ' ' VAL . 20.5 tt0 -157.61 -145.19 0.14 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.032 -1.44 . . . . 3.44 107.269 -170.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.548 ' H ' ' HG2' ' A' ' -6' ' ' GLU . 4.8 p 50.97 -67.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 C-N-CA 125.152 1.381 . . . . 1.67 114.57 176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . 0.451 ' N ' ' O ' ' A' ' -6' ' ' GLU . 55.5 tp 79.24 -60.58 0.35 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.82 1.045 . . . . 3.56 113.82 171.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -51.7 -77.6 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.345 1.239 . . . . 2.17 114.345 -166.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -95.37 83.68 3.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.746 -0.596 . . . . 3.2 111.503 -173.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 150.79 119.01 0.87 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 1.77 112.708 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 65.3 Cg_endo -85.99 -147.97 0.03 OUTLIER 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.609 2.873 . . . . 2.71 112.447 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.552 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 24.6 ptt180 -134.26 179.21 6.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.797 -0.183 . . . . 6.04 110.911 176.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -159.66 31.58 0.19 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.714 0.292 . . . . 3.6 111.483 -172.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.43 -106.99 0.35 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.502 0.927 . . . . 1.31 113.502 175.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.26 79.29 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.389 -0.91 . . . . 0.7 112.309 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.686 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m -110.55 -173.21 2.19 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.576 -0.812 . . . . 1.09 109.456 177.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.571 ' H ' HG23 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 1.61 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.538 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 1.04 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.538 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.7 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.714 ' HB2' ' OG1' ' A' ' 45' ' ' THR . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 1.28 112.189 -175.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 2.37 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 1.06 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.686 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 1.09 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.72 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 1.08 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 1.2 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.595 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 1.37 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.552 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.76 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 4.37 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.25 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 1.08 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 2.11 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.501 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.27 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.29 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 1.03 109.52 176.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.427 ' HB2' HD21 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 1.02 113.038 -177.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.42 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.751 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.624 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 1.27 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 1.02 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 1.04 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.751 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.82 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.77 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.404 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.87 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 2.35 112.093 176.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 1.25 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.616 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -82.02 111.49 27.51 Favored Pre-proline 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 4.01 110.738 -171.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.616 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 64.4 Cg_exo -56.79 117.87 4.62 Favored 'Trans proline' 0 CA--C 1.508 -0.786 0 C-N-CA 121.608 1.539 . . . . 0.94 108.809 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.7 tp -166.13 -74.68 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.689 -0.687 . . . . 2.33 110.551 -164.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.714 ' OG1' ' HB2' ' A' ' 10' ' ' CYS . 16.3 p -150.3 -165.02 2.16 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.118 -1.067 . . . . 3.66 108.118 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.42 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 47.6 ttm -168.97 -75.28 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 118.907 0.776 . . . . 6.7 110.979 -175.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -141.71 46.7 1.67 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.923 -1.035 . . . . 10.87 108.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.4 mttp 53.26 78.15 0.15 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.909 -1.042 . . . . 10.51 110.596 -172.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.521 -0.752 . . . . 7.0 110.409 -174.976 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 121.01 0.433 . . . . 17.59 110.145 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -133.61 -63.36 0.75 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 15.98 109.777 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 19.0 t60 59.52 67.78 0.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 15.96 111.098 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -129.32 20.13 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.602 -0.726 . . . . 14.95 110.092 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 54.0 m170 -102.97 13.42 34.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 13.19 111.098 -176.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -71.08 -47.01 60.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.637 0.256 . . . . 12.27 110.754 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -131.95 -43.16 0.98 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.89 -0.324 . . . . 10.26 111.016 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -60.14 -42.06 94.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.968 0.413 . . . . 10.28 110.798 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.1 m -124.38 53.1 1.46 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.135 -0.484 . . . . 7.15 109.943 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 20.8 t -63.0 -47.92 81.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.998 -0.546 . . . . 6.15 110.07 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 170.87 -70.02 0.13 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.484 -0.865 . . . . 3.18 112.506 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.523 HD21 ' H ' ' A' ' -7' ' ' LEU . 0.4 OUTLIER -95.09 59.64 2.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.312 0.577 . . . . 2.72 110.97 -174.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -86.67 49.99 1.91 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.614 -0.721 . . . . 3.44 111.087 -175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.524 HG23 ' CE1' ' A' ' -3' ' ' PHE . 6.0 p -148.37 122.18 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 1.67 110.782 -177.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 26.4 tp -145.55 57.31 1.24 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.997 0.427 . . . . 3.56 111.05 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.524 ' CE1' HG23 ' A' ' -5' ' ' VAL . 42.5 p90 -145.69 31.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.329 0.492 . . . . 2.17 112.329 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -177.98 61.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.757 0.28 . . . . 3.2 111.757 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 122.83 130.45 3.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.51 -0.852 . . . . 1.77 112.501 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -84.41 -64.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.58 2.186 . . . . 2.71 113.495 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.519 ' HG2' ' H ' ' A' ' 2' ' ' ARG . 68.2 ttt180 -175.49 177.69 1.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.567 -0.901 . . . . 6.04 108.567 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.519 ' H ' ' HG2' ' A' ' 1' ' ' ARG . 23.6 ttt180 -164.22 22.71 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.239 0.543 . . . . 3.6 110.532 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 52.11 -99.39 0.08 Allowed 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.958 1.096 . . . . 1.31 113.958 176.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.14 60.22 0.4 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 121.146 -0.55 . . . . 0.7 112.995 -170.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 13' ' ' THR . 4.0 m -102.62 -171.13 1.9 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.167 0.483 . . . . 1.09 110.021 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.6 ' H ' HG21 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 1.61 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.571 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 1.04 112.979 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.571 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.3 t30 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.7 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.547 ' SG ' HD22 ' A' ' 44' ' ' LEU . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 1.28 111.948 -175.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 2.37 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.415 ' H ' ' C ' ' A' ' 10' ' ' CYS . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 1.06 108.655 170.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 1.09 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.72 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.49 HG21 ' H ' ' A' ' 17' ' ' LEU . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 1.08 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 1.2 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.49 ' H ' HG21 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 1.37 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.76 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 4.37 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.25 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 1.08 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 2.11 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.27 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.591 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.29 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.514 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 1.03 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.445 ' CA ' HG22 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.494 ' ND2' ' HA ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 1.02 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.42 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.629 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 1.27 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.482 ' HB2' HH11 ' A' ' 42' ' ' ARG . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 1.02 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 1.04 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.753 ' HE2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.82 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.77 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.87 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 2.35 111.91 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 38' ' ' HIS . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 1.25 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.597 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.588 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 -95.44 106.89 29.42 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 4.01 110.117 -174.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.597 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 51.7 Cg_exo -57.5 117.23 3.89 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 121.574 1.516 . . . . 0.94 108.737 170.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.547 HD22 ' SG ' ' A' ' 10' ' ' CYS . 11.9 tp -159.28 -73.62 0.08 Allowed 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.823 -0.626 . . . . 2.33 111.88 -162.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' A' ' 46' ' ' MET . 17.1 p -140.69 -152.07 0.39 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.74 -0.664 . . . . 3.66 109.902 -176.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.419 ' H ' ' HB ' ' A' ' 45' ' ' THR . 43.3 tpp -142.86 168.18 20.33 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.53 -0.544 . . . . 6.7 109.53 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -44.49 -53.47 6.95 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.768 0.668 . . . . 10.87 111.387 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -132.78 84.07 2.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.359 -0.608 . . . . 10.51 109.359 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.441 -0.79 . . . . 7.0 109.468 179.25 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 60.7 ttp . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.845 0.355 . . . . 17.59 110.386 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . 0.407 ' HB1' ' HB3' ' A' ' -14' ' ' HIS . . . -136.67 109.61 7.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.104 -0.498 . . . . 15.98 110.136 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -67.57 -25.74 65.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 15.96 111.309 -176.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.26 63.96 1.16 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.351 -0.611 . . . . 14.95 109.351 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . 0.407 ' HB3' ' HB1' ' A' ' -17' ' ' ALA . 19.7 p-80 -86.79 139.98 30.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.786 -0.643 . . . . 13.19 110.703 -178.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -176.11 -37.78 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.826 -0.625 . . . . 12.27 109.332 -177.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 67.91 -76.3 0.06 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 114.964 -1.016 . . . . 10.26 111.364 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -149.91 -59.79 0.2 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.577 -0.527 . . . . 10.28 109.577 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 25.3 m 64.27 98.36 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.783 0.677 . . . . 7.15 112.207 175.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -9' ' ' SER . . . . . 0.404 ' HA ' ' OE2' ' A' ' -6' ' ' GLU . 67.7 m -147.37 79.02 1.49 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.559 -0.746 . . . . 6.15 109.682 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.12 -126.79 4.29 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.918 -0.658 . . . . 3.18 112.296 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.568 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -86.37 72.62 10.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.703 0.763 . . . . 2.72 111.464 -177.448 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . 0.404 ' OE2' ' HA ' ' A' ' -9' ' ' SER . 36.4 mt-10 -104.73 29.95 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 3.44 111.774 -175.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.588 HG12 ' CZ ' ' A' ' 19' ' ' ARG . 4.3 p -127.81 127.68 68.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.905 -0.406 . . . . 1.67 109.905 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.9 pp -115.28 19.66 15.42 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.409 0.522 . . . . 3.56 112.409 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' -2' ' ' GLN . 17.2 p90 -134.69 106.32 6.89 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.62 -0.432 . . . . 2.17 111.727 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.497 ' OE1' ' HB2' ' A' ' 20' ' ' ARG . 7.1 tp-100 158.57 -74.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.663 1.185 . . . . 3.2 110.51 170.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -137.34 160.21 25.0 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.545 -0.836 . . . . 1.77 112.625 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -84.72 -67.31 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.352 2.701 . . . . 2.71 113.47 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -172.33 -178.71 2.09 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.296 0.238 . . . . 6.04 110.494 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -161.89 -12.18 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.696 -0.229 . . . . 3.6 111.051 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.03 -100.53 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.235 0.828 . . . . 1.31 113.235 171.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.23 57.46 2.06 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.363 -0.446 . . . . 0.7 112.762 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.506 HG21 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -112.9 -176.5 2.91 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.279 -0.541 . . . . 1.09 110.637 -176.569 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' HG21 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 1.61 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.525 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 1.04 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.525 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.7 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 1.28 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 2.37 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 1.06 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.501 HG23 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 1.09 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.583 ' O ' HG21 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.72 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.475 HG23 ' H ' ' A' ' 17' ' ' LEU . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 1.08 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 1.2 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.745 HD22 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 1.37 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.588 ' CZ ' HG12 ' A' ' -5' ' ' VAL . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.76 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.516 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 4.37 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.25 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 1.08 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 2.11 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.27 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.658 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.29 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 1.03 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.461 ' HB2' ' OG1' ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.745 ' OD1' HD22 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 1.02 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.521 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.42 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.576 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 1.27 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.539 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 1.02 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 1.04 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.82 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.77 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.87 114.077 -162.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 2.35 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 1.25 110.098 175.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.595 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.701 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.5 tmt_? -94.77 108.25 36.29 Favored Pre-proline 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 4.01 109.37 -169.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.595 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.9 Cg_exo -55.12 119.75 7.04 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.026 1.817 . . . . 0.94 110.841 173.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 9.2 mt -124.45 -147.29 0.37 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.811 -0.631 . . . . 2.33 110.138 -172.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.3 p -135.37 -149.03 0.32 Allowed 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.861 -0.792 . . . . 3.66 108.861 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 63.2 mmm -102.25 -158.59 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.103 -0.702 . . . . 6.7 109.103 176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -88.7 80.28 7.29 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.226 0.536 . . . . 10.87 110.636 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 tttm 55.5 86.4 0.06 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 114.532 -1.213 . . . . 10.51 112.329 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.911 -0.566 . . . . 7.0 109.651 174.657 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.091 -0.337 . . . . 17.59 110.091 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -106.82 52.15 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.167 0.508 . . . . 15.98 110.469 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . 0.624 ' HB3' ' O ' ' A' ' -12' ' ' HIS . 33.3 m80 -98.13 -74.12 0.59 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.815 -0.63 . . . . 15.96 109.609 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 52.0 m80 64.76 168.23 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.734 0.646 . . . . 14.95 111.567 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 t60 59.39 56.9 3.56 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.025 -0.534 . . . . 13.19 110.375 178.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 34.8 t60 70.83 -69.71 0.17 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.355 -0.839 . . . . 12.27 110.633 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . 0.624 ' O ' ' HB3' ' A' ' -16' ' ' HIS . 10.5 t60 -126.15 -50.45 1.55 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.458 -0.942 . . . . 10.26 108.458 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -178.23 -62.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.213 -0.903 . . . . 10.28 108.945 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 57.6 m -157.9 92.91 1.22 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.522 -0.763 . . . . 7.15 109.198 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 25.1 m 66.07 88.49 0.11 Allowed 'General case' 0 CA--C 1.53 0.186 0 O-C-N 123.69 0.619 . . . . 6.15 110.231 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -102.36 -149.25 21.75 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.668 -0.777 . . . . 3.18 111.733 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.609 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 4.2 mp -81.9 56.35 3.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.5 0.667 . . . . 2.72 109.717 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -114.08 62.97 0.66 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.354 -0.839 . . . . 3.44 111.331 -173.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.429 HG21 ' CE1' ' A' ' -3' ' ' PHE . 2.5 p -142.18 100.02 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.433 0.635 . . . . 1.67 110.555 178.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 32.4 tp -136.27 55.99 1.83 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.99 -0.55 . . . . 3.56 110.405 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' -5' ' ' VAL . 32.8 p90 -131.21 6.11 4.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.362 -0.381 . . . . 2.17 111.565 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 177.51 82.59 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.427 -0.351 . . . . 3.2 110.475 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 149.77 156.94 7.46 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.294 -0.955 . . . . 1.77 113.57 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -96.48 -159.16 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.964 3.11 . . . . 2.71 112.6 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -146.6 -178.66 6.29 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.3 -0.409 . . . . 6.04 110.668 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.484 ' HG2' ' H ' ' A' ' 3' ' ' ALA . 64.5 ttt-85 -166.32 -178.81 4.7 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.914 -1.143 . . . . 3.6 107.914 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.484 ' H ' ' HG2' ' A' ' 2' ' ' ARG . . . -118.04 -78.12 0.58 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.624 1.102 . . . . 1.31 112.587 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.8 65.34 4.14 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.234 -0.508 . . . . 0.7 112.729 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 13' ' ' THR . 0.2 OUTLIER -121.0 177.96 4.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.723 0.761 . . . . 1.09 111.15 -176.042 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.455 ' HA ' HG23 ' A' ' 13' ' ' THR . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 1.61 109.609 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 1.04 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.587 ' H ' ' C ' ' A' ' 7' ' ' CYS . 6.5 t30 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.7 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.476 ' SG ' HD13 ' A' ' 44' ' ' LEU . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 1.28 111.788 -175.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 2.37 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 10' ' ' CYS . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 1.06 107.988 168.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 1.09 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.72 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.462 HG23 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 1.08 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 1.2 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.462 ' H ' HG23 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 1.37 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.483 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.454 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.76 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.523 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 4.37 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.25 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 1.08 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 2.11 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.523 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.27 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.29 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.608 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 1.03 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.609 ' CG ' ' HA ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 1.02 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.608 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.42 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.79 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.668 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 1.27 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.601 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 1.02 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 1.04 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.82 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.77 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.418 ' O ' HG21 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.87 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 m120 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 2.35 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 1.25 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.571 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.601 ' HG2' ' CB ' ' A' ' 34' ' ' TYR . 1.4 tmt_? -96.77 109.23 47.6 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 4.01 110.543 -168.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.2 Cg_exo -59.48 145.36 98.2 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 121.925 1.75 . . . . 0.94 110.4 171.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD13 ' ND2' ' A' ' 9' ' ' ASN . 0.9 OUTLIER -142.37 -90.94 0.13 Allowed 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.483 -0.487 . . . . 2.33 110.852 -169.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.429 ' HB ' ' H ' ' A' ' 46' ' ' MET . 6.1 p -163.09 -155.52 0.34 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.922 -1.14 . . . . 3.66 107.922 -177.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.429 ' H ' ' HB ' ' A' ' 45' ' ' THR . 75.8 mmm -105.91 65.46 0.7 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.618 -0.882 . . . . 6.7 108.618 172.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 65.31 31.91 10.22 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 114.987 -1.006 . . . . 10.87 111.132 -176.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 tttm 53.99 84.96 0.06 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.754 -1.112 . . . . 10.51 112.832 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 C--O 1.25 1.089 0 CA-C-N 115.871 -0.604 . . . . 7.0 111.252 174.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.34 -0.245 . . . . 17.59 110.34 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -74.57 -26.77 60.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.418 0.628 . . . . 15.98 110.268 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -118.25 93.18 4.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.397 -0.819 . . . . 15.96 109.741 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -134.36 96.82 3.67 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.692 -0.685 . . . . 14.95 110.38 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -64.33 154.58 34.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 13.19 111.165 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.1 m170 60.12 81.66 0.17 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.773 -0.649 . . . . 12.27 111.866 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -134.56 40.21 2.99 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 10.26 110.572 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . 0.487 ' HA ' ' CD ' ' A' ' -6' ' ' GLU . 28.8 m80 59.95 63.66 1.41 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.342 -0.844 . . . . 10.28 110.066 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.2 m -93.81 -69.64 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.587 -0.733 . . . . 7.15 111.857 -173.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 12.8 p -148.77 24.56 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.713 0.292 . . . . 6.15 111.549 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.61 -159.39 34.48 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.432 -0.889 . . . . 3.18 111.715 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.425 ' N ' HD23 ' A' ' -7' ' ' LEU . 1.1 mm? -89.68 70.7 7.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.124 -1.065 . . . . 2.72 108.124 175.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . 0.487 ' CD ' ' HA ' ' A' ' -11' ' ' HIS . 31.4 mt-10 -126.02 67.33 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 3.44 111.944 -168.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.552 HG12 ' HD2' ' A' ' 19' ' ' ARG . 4.8 p -111.79 106.34 20.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 1.67 108.897 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -93.32 46.0 1.19 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.259 0.466 . . . . 3.56 112.259 -169.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.525 ' O ' ' HB3' ' A' ' -2' ' ' GLN . 5.0 p90 -176.43 175.8 1.72 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.474 -0.33 . . . . 2.17 110.735 177.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.525 ' HB3' ' O ' ' A' ' -3' ' ' PHE . 5.7 tp60 91.65 -73.56 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.005 1.322 . . . . 3.2 112.07 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -168.32 -166.59 27.64 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 119.262 -1.447 . . . . 1.77 114.116 -175.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -94.02 -141.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.858 3.038 . . . . 2.71 112.837 -176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -116.19 -169.39 1.6 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.476 -0.329 . . . . 6.04 110.217 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -151.71 16.55 0.69 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.522 0.677 . . . . 3.6 109.98 -178.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.6 -100.93 0.08 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.563 0.949 . . . . 1.31 113.563 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.34 65.51 0.25 Allowed Glycine 0 CA--C 1.523 0.587 0 C-N-CA 121.305 -0.474 . . . . 0.7 112.854 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -109.85 -171.83 1.92 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 117.691 0.745 . . . . 1.09 110.733 -178.213 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.559 ' H ' HG21 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 1.61 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.582 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 1.04 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.582 ' H ' ' C ' ' A' ' 7' ' ' CYS . 11.2 t30 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.7 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.643 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 1.28 112.687 -174.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 2.37 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 1.06 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 1.09 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.72 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.416 HG21 ' H ' ' A' ' 17' ' ' LEU . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 1.08 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 1.2 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 1.37 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.76 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HG3' ' HA2' ' A' ' 24' ' ' GLY . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 4.37 110.151 176.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.25 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 1.08 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 2.11 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HG3' ' A' ' 20' ' ' ARG . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.27 110.975 -177.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.428 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.428 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.29 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 1.03 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.415 ' CA ' HG22 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.666 ' C ' HD21 ' A' ' 29' ' ' ASN . 0.2 OUTLIER -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 1.02 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.42 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.468 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HB ' ' A' ' -5' ' ' VAL . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 1.27 108.813 174.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.522 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 1.02 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 1.04 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.82 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.77 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 80.2 m-70 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.87 114.405 -165.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 2.35 111.351 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 1.25 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.607 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 -88.3 110.01 32.91 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 4.01 110.83 -173.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.4 Cg_exo -55.82 117.52 4.16 Favored 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 121.681 1.587 . . . . 0.94 109.466 169.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.643 HD23 ' SG ' ' A' ' 10' ' ' CYS . 6.1 tp -159.49 -69.73 0.08 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.49 -0.777 . . . . 2.33 110.795 -165.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.04 -105.29 0.17 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.601 -0.727 . . . . 3.66 110.966 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.513 ' HG2' ' H ' ' A' ' 47' ' ' LYS . 12.9 ttt -124.74 -173.72 2.86 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.267 -0.642 . . . . 6.7 109.267 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.513 ' H ' ' HG2' ' A' ' 46' ' ' MET . 57.2 mtpt -73.95 67.69 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.085 0.469 . . . . 10.87 110.469 176.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.429 ' CD ' ' HA ' ' A' ' 9' ' ' ASN . 30.2 mmtp 57.95 82.38 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.081 -0.963 . . . . 10.51 111.554 -177.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.413 -0.804 . . . . 7.0 109.331 179.271 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.808 0.337 . . . . 17.59 110.288 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -117.34 96.08 5.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.095 0.474 . . . . 15.98 110.044 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -81.82 -29.98 32.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.744 -0.662 . . . . 15.96 110.368 -176.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.4 t-80 -91.56 -51.22 5.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.9 -0.591 . . . . 14.95 110.134 -177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -79.7 108.58 13.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 13.19 110.529 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -92.58 2.27 56.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.296 0.569 . . . . 12.27 110.444 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -123.13 40.19 3.77 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.492 -0.776 . . . . 10.26 109.698 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -97.28 -72.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 10.28 110.705 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -10' ' ' SER . . . . . 0.589 ' HA ' ' CG ' ' A' ' -6' ' ' GLU . 65.1 m -93.44 3.83 54.95 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.404 0.621 . . . . 7.15 110.963 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 6.9 p -95.96 19.18 11.92 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.595 -0.73 . . . . 6.15 110.58 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -149.38 -109.17 0.49 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.324 -0.941 . . . . 3.18 113.63 -176.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.59 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.8 OUTLIER -82.97 53.51 2.45 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.611 0.967 . . . . 2.72 113.611 -168.409 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . 0.589 ' CG ' ' HA ' ' A' ' -10' ' ' SER . 7.0 mm-40 -90.17 50.78 1.91 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 3.44 111.424 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.439 ' O ' HG21 ' A' ' -5' ' ' VAL . 14.0 p -139.46 34.59 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.926 0.87 . . . . 1.67 109.154 177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 37.8 tp -76.17 57.34 1.11 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.577 -0.738 . . . . 3.56 111.116 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . 0.482 ' CD2' ' HG2' ' A' ' -2' ' ' GLN . 15.3 p90 -156.79 14.74 0.28 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.711 -0.677 . . . . 2.17 110.548 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.482 ' HG2' ' CD2' ' A' ' -3' ' ' PHE . 82.4 mm-40 -143.7 33.7 1.28 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.257 -0.429 . . . . 3.2 111.349 -175.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . 0.408 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . 134.09 155.41 7.57 Favored Glycine 0 CA--C 1.524 0.622 0 C-N-CA 120.262 -0.971 . . . . 1.77 113.674 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 6.2 Cg_endo -90.21 -144.25 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.979 3.119 . . . . 2.71 112.632 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.424 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 16.8 ptp180 -121.72 -163.71 1.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.598 -0.274 . . . . 6.04 110.432 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -158.63 1.42 0.1 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.745 0.307 . . . . 3.6 111.029 -179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.4 -94.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.618 0.969 . . . . 1.31 113.618 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.11 60.95 0.32 Allowed Glycine 0 CA--C 1.52 0.352 0 C-N-CA 121.167 -0.539 . . . . 0.7 113.17 -170.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -111.08 -171.8 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.078 0.439 . . . . 1.09 110.164 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.554 ' H ' HG23 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 1.61 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 1.04 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.554 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.2 t30 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.7 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.669 ' SG ' HD23 ' A' ' 44' ' ' LEU . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 1.28 112.058 -176.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 2.37 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.433 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 1.06 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.47 HG22 ' HA ' ' A' ' 6' ' ' CYS . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 1.09 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.467 ' O ' HG21 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.72 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.459 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 1.08 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 1.2 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.811 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 1.37 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.433 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.811 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.76 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.413 ' HG3' ' HA2' ' A' ' 24' ' ' GLY . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 4.37 110.914 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.25 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 1.08 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 2.11 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.413 ' HA2' ' HG3' ' A' ' 20' ' ' ARG . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.27 112.105 177.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.29 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.575 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 1.03 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD22 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 1.02 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.42 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.565 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD11 ' HB ' ' A' ' -5' ' ' VAL . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 1.27 108.801 174.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.628 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 1.02 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 1.04 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.565 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.82 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.77 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.87 114.559 -167.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 2.35 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 1.25 110.131 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.647 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.628 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -98.92 100.68 10.28 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 4.01 109.445 -174.575 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.647 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.0 Cg_exo -59.54 117.67 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.045 1.83 . . . . 0.94 111.942 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.669 HD23 ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -125.92 -84.79 0.63 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.256 -0.884 . . . . 2.33 109.663 174.955 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 42.86 37.86 1.21 Allowed 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.901 -1.045 . . . . 3.66 113.436 -178.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 90.1 mmm 63.78 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.356 0.889 0 CA-C-O 121.415 0.626 . . . . 6.7 110.802 -176.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -128.0 -65.17 0.92 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.127 -0.942 . . . . 10.87 109.168 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -166.95 88.17 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.499 -0.773 . . . . 10.51 110.246 174.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-N 116.439 -0.346 . . . . 7.0 110.378 177.986 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -18' ' ' MET . . . . . 0.465 ' HB3' ' O ' ' A' ' -15' ' ' HIS . 1.7 mpt? . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 121.079 0.466 . . . . 17.59 110.606 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.62 -28.04 23.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.241 -0.436 . . . . 15.98 111.165 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -82.34 -45.3 15.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.8 0.333 . . . . 15.96 110.345 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' A' ' -18' ' ' MET . 45.3 p-80 -128.73 129.23 45.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.722 -0.473 . . . . 14.95 109.722 176.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -102.27 142.82 32.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.159 -0.473 . . . . 13.19 110.56 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -73.87 113.26 10.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 12.27 109.721 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -90.09 90.82 8.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.21 0.529 . . . . 10.26 110.978 -176.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -95.17 114.53 26.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.643 -0.708 . . . . 10.28 109.602 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 90.73 1.07 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.042 0.448 . . . . 7.15 110.174 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.6 t -86.17 62.19 7.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.155 0.502 . . . . 6.15 110.809 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -73.82 -29.11 63.68 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 111.236 -0.746 . . . . 3.18 111.236 175.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.599 ' H ' HD22 ' A' ' -7' ' ' LEU . 1.1 pt? -75.78 60.55 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.9 0.857 . . . . 2.72 110.428 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -86.47 -21.07 27.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.938 -1.028 . . . . 3.44 111.13 -176.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.431 ' HB ' HD11 ' A' ' 33' ' ' LEU . 11.3 p -77.27 120.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.838 -0.619 . . . . 1.67 110.745 -177.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 44.3 tp -117.3 -23.38 7.85 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.015 0.436 . . . . 3.56 110.722 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -83.24 140.55 32.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.99 -0.55 . . . . 2.17 110.93 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.46 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 16.0 mm100 53.1 72.46 0.42 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.805 -0.634 . . . . 3.2 111.56 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -178.91 124.34 0.91 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.377 -0.916 . . . . 1.77 113.188 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -77.4 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 123.323 2.682 . . . . 2.71 112.063 174.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -155.27 158.21 38.45 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 6.04 110.134 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.454 ' O ' ' HD1' ' A' ' 18' ' ' TRP . 18.7 ttt180 -158.54 175.75 13.27 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.679 -0.86 . . . . 3.6 108.679 -177.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.29 166.32 28.36 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.964 -0.384 . . . . 1.31 109.964 170.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.86 40.16 49.15 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 120.955 -0.64 . . . . 0.7 112.756 -173.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.471 ' O ' HG21 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.2 178.64 4.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.697 -0.296 . . . . 1.09 111.03 -174.186 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.467 ' H ' HG23 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 1.61 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.509 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 1.04 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.509 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.7 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 1.28 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 2.37 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 1.06 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 1.09 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.72 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.503 HG22 ' H ' ' A' ' 17' ' ' LEU . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 1.08 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 1.2 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.503 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 1.37 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.454 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.76 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 4.37 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.25 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 1.08 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 2.11 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.27 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.528 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.29 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 1.03 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.453 ' HA ' HG23 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' H ' HG23 ' A' ' 15' ' ' THR . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.403 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 1.02 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.42 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.744 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.63 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 1.27 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.406 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 1.02 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 1.04 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.744 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.82 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.77 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.87 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 2.35 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 1.25 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.511 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HB2' ' HB3' ' A' ' 34' ' ' TYR . 48.3 ttt180 -84.11 114.16 52.67 Favored Pre-proline 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 4.01 110.38 -172.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 89.2 Cg_exo -53.84 116.99 3.39 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.731 1.621 . . . . 0.94 110.503 171.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.6 tp -159.64 -142.78 0.09 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.063 -0.971 . . . . 2.33 108.39 -168.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.4 m 79.66 -50.49 0.39 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.954 0.784 . . . . 3.66 112.284 168.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.411 ' CG ' ' HB2' ' A' ' 49' ' ' GLU . 12.5 tpt -162.64 165.84 25.29 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.254 -1.017 . . . . 6.7 108.254 -178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.3 75.25 1.0 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.811 -0.44 . . . . 10.87 109.811 176.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 59.78 82.73 0.15 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.861 -1.063 . . . . 10.51 111.557 -175.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.411 ' HB2' ' CG ' ' A' ' 46' ' ' MET . 38.3 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.68 -0.676 . . . . 7.0 110.089 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.735 0.303 . . . . 17.59 111.068 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.98 151.99 22.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.817 0.341 . . . . 15.98 111.312 -176.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -136.89 123.13 20.53 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.896 -0.593 . . . . 15.96 109.761 175.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -84.66 67.89 10.18 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.677 0.751 . . . . 14.95 110.722 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -83.05 -35.08 26.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.469 -0.787 . . . . 13.19 110.089 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -135.92 145.04 45.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.913 -0.585 . . . . 12.27 109.929 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -157.38 -23.11 0.09 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.636 0.255 . . . . 10.26 110.425 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 31.5 m-70 72.89 -68.44 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.646 0.778 . . . . 10.28 111.389 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 7.6 m -81.25 116.4 21.11 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.972 -0.381 . . . . 7.15 109.972 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 23.1 t -112.92 -50.33 2.89 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.873 0.368 . . . . 6.15 110.624 -178.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -81.87 77.91 2.01 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 3.18 112.043 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -7' ' ' LEU . . . . . 0.479 ' C ' HD23 ' A' ' 17' ' ' LEU . 84.0 mt -92.73 77.08 4.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.796 0.331 . . . . 2.72 110.529 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -158.48 142.93 15.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 3.44 111.094 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' VAL . . . . . 0.477 HG13 ' CZ ' ' A' ' 19' ' ' ARG . 5.0 p -126.66 1.76 4.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.243 0.544 . . . . 1.67 109.656 173.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 62.9 mt 77.55 -65.38 0.27 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 114.905 -1.043 . . . . 3.56 111.859 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -88.91 177.95 6.55 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.698 0.259 . . . . 2.17 111.698 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLN . . . . . 0.552 ' HB3' HH12 ' A' ' 19' ' ' ARG . 34.4 tp60 62.91 97.3 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.889 -0.596 . . . . 3.2 110.203 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -58.67 115.92 7.87 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.287 -0.415 . . . . 1.77 113.743 -174.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -94.25 146.01 1.85 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.513 2.809 . . . . 2.71 112.884 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -177.22 128.72 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.363 -0.38 . . . . 6.04 110.691 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.452 ' HB2' ' CB ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER 174.74 -32.24 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 O-C-N 123.637 0.586 . . . . 3.6 111.247 174.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.34 -83.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.398 0.888 . . . . 1.31 113.398 173.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.49 65.46 0.25 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 121.435 -0.412 . . . . 0.7 112.437 -174.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.605 ' O ' HG23 ' A' ' 13' ' ' THR . 3.1 m -121.63 -172.49 2.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.432 0.616 . . . . 1.09 110.756 -175.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.589 ' H ' HG23 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 1.61 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 1.04 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.542 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.7 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.435 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 1.28 111.873 -172.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 2.37 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 1.06 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.605 HG23 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 1.09 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.41 ' O ' HG21 ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.72 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.574 HG23 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 1.08 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 1.2 110.489 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' H ' HG23 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 1.37 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.452 ' CB ' ' HB2' ' A' ' 2' ' ' ARG . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.555 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.76 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.527 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 4.37 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.25 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 1.08 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 2.11 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.27 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.566 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.29 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 1.03 109.529 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.419 HD22 HD12 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 1.02 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.497 ' SG ' HD12 ' A' ' 44' ' ' LEU . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.42 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.726 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.677 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 1.27 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 1.02 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 1.04 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.726 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.82 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.77 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.429 ' O ' HG21 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.87 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 2.35 112.063 176.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 1.25 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.555 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.714 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.4 tmt_? -90.63 110.43 41.28 Favored Pre-proline 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 4.01 109.512 -172.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.555 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 83.9 Cg_exo -54.02 120.52 8.06 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.301 2.0 . . . . 0.94 111.432 172.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 10.7 mt -123.65 -140.97 0.31 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.77 -0.65 . . . . 2.33 109.514 -170.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.42 ' HB ' ' H ' ' A' ' 46' ' ' MET . 6.5 m 69.61 -86.82 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 123.552 0.533 . . . . 3.66 110.961 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.42 ' H ' ' HB ' ' A' ' 45' ' ' THR . 45.2 tpp 53.62 84.0 0.06 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.419 0.687 . . . . 6.7 110.879 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tptt 66.64 37.23 4.45 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.575 -0.739 . . . . 10.87 109.666 -177.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 tttp 48.93 74.1 0.2 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.339 -1.3 . . . . 10.51 112.737 -177.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.465 -0.778 . . . . 7.0 109.992 173.444 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.661 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.009 -0.043 . . . . 0.38 111.019 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.661 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 0.86 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 0.31 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.57 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 0.76 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 1.9 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 0.33 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 0.42 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.498 ' O ' HG23 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.26 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 0.4 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 0.54 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 0.79 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.499 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.03 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 3.9 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.2 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 0.36 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 1.61 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.518 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.22 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.524 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.524 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.21 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 0.12 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.519 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 0.21 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.41 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.603 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 0.54 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 0.44 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.57 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.23 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.19 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.02 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 1.87 111.953 176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 0.59 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 20.0 ttt180 . . . . . 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 3.32 110.693 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.694 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 110.59 -0.152 . . . . 0.38 110.59 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.694 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 0.86 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.49 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.485 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 0.31 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.57 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 0.76 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 1.9 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 0.33 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 0.42 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.26 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.683 HG22 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 0.4 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 0.54 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.734 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 0.79 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.738 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.03 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 3.9 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.2 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 0.36 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 1.61 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.536 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.22 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.21 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 0.12 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.639 ' HA ' HG21 ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.492 ' ND2' HD23 ' A' ' 17' ' ' LEU . 42.6 t-20 -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 0.21 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.41 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 0.54 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 0.44 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 0.57 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.23 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.19 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.448 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.02 113.991 -160.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 1.87 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 0.59 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 3.32 110.659 -175.675 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.703 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m . . . . . 0 C--O 1.223 -0.34 0 N-CA-C 110.554 -0.165 . . . . 0.38 110.554 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.611 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 0.86 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 0.31 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.568 ' H ' ' C ' ' A' ' 7' ' ' CYS . 27.5 t-20 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.57 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 0.76 112.275 -175.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 1.9 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 0.33 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 0.42 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.26 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.559 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 0.4 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 0.54 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.559 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 0.79 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.03 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.529 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 3.9 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.2 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 0.36 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 1.61 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.529 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.22 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.605 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.605 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.21 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.583 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 0.12 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.429 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.532 ' ND2' HD23 ' A' ' 17' ' ' LEU . 38.6 t-20 -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 0.21 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.583 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.41 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.767 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.798 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 0.54 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 0.44 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.57 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.23 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.798 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.19 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.452 ' O ' HG22 ' A' ' 40' ' ' VAL . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.02 114.084 -165.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 1.87 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 0.59 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.567 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 3.32 109.342 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.036 0.013 . . . . 0.38 111.036 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.673 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 0.86 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.489 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 0.31 113.803 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.57 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 0.76 111.337 -171.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 1.9 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 0.33 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 0.42 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.26 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 0.4 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 0.54 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.699 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 0.79 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.03 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.542 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 3.9 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.2 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.702 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 0.36 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 1.61 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.542 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.22 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.21 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 0.12 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.653 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.511 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 0.21 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.41 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.73 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 0.54 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 0.44 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.702 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 0.57 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.73 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.23 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.19 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.449 ' O ' HG22 ' A' ' 40' ' ' VAL . 34.2 m170 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.02 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 1.87 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 0.59 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 2.7 tmt_? . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 3.32 109.151 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.728 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 111.148 0.055 . . . . 0.38 111.148 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.728 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 0.86 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 0.31 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.491 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.57 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 0.76 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 1.9 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 0.33 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 0.42 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.26 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 0.4 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 0.54 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.705 ' H ' HG22 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 0.79 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.634 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.03 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.519 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 3.9 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.2 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 0.36 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 1.61 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.519 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.22 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.497 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.21 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.41 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 0.12 109.293 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.541 ' HB2' HD23 ' A' ' 17' ' ' LEU . 3.9 t30 -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 0.21 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.41 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.41 111.661 -175.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 0.54 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.723 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 0.44 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 0.57 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.23 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.19 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.44 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.02 114.601 -161.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 1.87 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 38' ' ' HIS . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 0.59 109.914 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.723 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 3.32 110.414 -174.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.715 ' O ' HG22 ' A' ' 13' ' ' THR . 0.7 OUTLIER . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 109.926 -0.398 . . . . 0.38 109.926 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.597 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 0.86 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.586 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 0.31 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.586 ' H ' ' C ' ' A' ' 7' ' ' CYS . 27.8 t-20 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.57 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 0.76 112.513 -175.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 1.9 113.529 -172.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.432 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 0.33 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.715 HG22 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 0.42 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.26 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.65 HG21 ' HA ' ' A' ' 28' ' ' CYS . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 0.4 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 0.54 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.624 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 0.79 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HH2' ' O ' ' A' ' 12' ' ' THR . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.624 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.03 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 3.9 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.2 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 0.36 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 1.61 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.22 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.499 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.21 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 0.12 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.65 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 0.21 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.41 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.817 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 0.54 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.606 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 0.44 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 0.57 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.562 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.23 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.817 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.19 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.02 114.436 -166.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 1.87 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.434 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 0.59 109.768 175.58 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.606 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 3.32 109.062 -174.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 110.35 -0.241 . . . . 0.38 110.35 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.662 ' H ' HG22 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 0.86 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 0.31 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 27.5 t-20 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.57 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 0.76 112.131 -175.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 1.9 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 0.33 109.271 173.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 0.42 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 0.4 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 0.54 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.676 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 0.79 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.03 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 3.9 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.2 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 0.36 113.349 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 1.61 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.22 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.467 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.21 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.563 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 0.12 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 0.21 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.716 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.41 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.721 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 0.54 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HE1' HG23 ' A' ' 40' ' ' VAL . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 0.44 111.414 -173.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 0.57 110.558 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.721 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.23 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.19 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.02 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.9 t30 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 1.87 111.972 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.593 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 0.59 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.716 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 . . . . . 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 3.32 110.433 -174.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.7 m . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 110.586 -0.153 . . . . 0.38 110.586 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 0.86 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 0.31 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.57 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 0.76 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 1.9 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 0.33 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 0.42 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.26 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 0.4 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.54 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' THR . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 0.79 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.03 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.64 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 3.9 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.2 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 0.36 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 1.61 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.22 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.21 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB2' HG21 ' A' ' 15' ' ' THR . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 0.21 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.41 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.714 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 0.54 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 0.44 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 0.57 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.23 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.19 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.02 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.5 t30 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 1.87 112.202 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.59 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 3.32 110.772 -167.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.516 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 119.986 -0.054 . . . . 0.38 111.116 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 0.86 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.485 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 0.31 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.57 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 0.76 112.308 -173.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 1.9 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 0.33 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 0.42 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.26 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.635 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 0.4 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 0.54 111.584 -178.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 0.79 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.03 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 3.9 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.2 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 0.36 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 1.61 108.196 -173.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.22 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.21 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 0.12 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.526 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.454 ' H ' HG21 ' A' ' 15' ' ' THR . 38.1 t-20 -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 0.21 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.41 111.614 -173.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.595 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 0.54 109.585 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 0.44 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 0.57 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.23 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.19 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.02 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 1.87 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.411 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 0.59 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 3.32 110.154 -176.212 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.635 -0.135 . . . . 0.38 110.635 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 0.86 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.427 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 0.31 113.4 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.52 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.57 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 0.76 111.775 -172.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 1.9 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 0.33 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 0.42 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.476 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.26 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.618 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 0.4 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 0.54 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.618 ' H ' HG22 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 0.79 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.03 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 3.9 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.2 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 0.36 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 1.61 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.22 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.52 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.21 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 0.12 109.09 177.439 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.465 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 0.21 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.41 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.74 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 0.54 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.425 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 0.44 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 0.57 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.23 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.19 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.02 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 1.87 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 0.59 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 2.0 tmt_? . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 3.32 109.192 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 CA--C 1.534 0.349 0 N-CA-C 110.634 -0.136 . . . . 0.38 110.634 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.693 ' H ' HG22 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 0.86 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 0.31 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.574 ' H ' ' C ' ' A' ' 7' ' ' CYS . 25.6 t-20 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.57 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 0.76 111.953 -175.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 1.9 113.772 -171.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 0.33 108.911 171.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 0.42 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.26 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 0.4 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 0.54 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.629 ' H ' HG22 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 0.79 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.509 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.03 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.7 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 3.9 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' ASP . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.2 109.042 171.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 0.36 113.99 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 1.61 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.22 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.7 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.21 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.12 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.555 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.452 ' H ' HG21 ' A' ' 15' ' ' THR . 38.9 t-20 -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 0.21 113.416 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.41 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.729 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.689 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 0.54 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 0.44 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.57 111.383 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.23 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.19 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.02 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 1.87 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 0.59 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 58.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 3.32 110.872 -173.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 119.959 -0.067 . . . . 0.38 111.09 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.702 ' H ' HG22 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 0.86 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.575 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 0.31 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.575 ' H ' ' C ' ' A' ' 7' ' ' CYS . 26.8 t-20 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.57 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 0.76 112.188 -175.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 1.9 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 0.33 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 0.42 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.26 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.623 HG21 ' HA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.4 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 0.54 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.654 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 0.79 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.03 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.704 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 3.9 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.422 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.2 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 0.36 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 1.61 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.532 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.22 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.704 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.21 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 0.12 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 0.21 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.41 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.585 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.717 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 0.54 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.511 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 0.44 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.495 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 0.57 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.23 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.19 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.02 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 1.87 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 0.59 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 3.32 109.777 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.689 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 109.456 -0.572 . . . . 0.38 109.456 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.66 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 0.86 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 0.31 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.57 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 0.76 112.189 -175.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 1.9 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 0.33 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.689 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 0.42 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.503 ' O ' HG23 ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.26 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.66 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 0.4 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 0.54 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.66 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 0.79 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.03 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.561 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 3.9 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.2 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 0.36 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 1.61 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.22 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.21 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 0.12 109.52 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.485 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.615 ' HB2' HD23 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 0.21 113.038 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.41 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.756 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 0.54 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 0.44 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 0.57 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.756 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.23 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.19 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.479 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.02 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 1.87 112.093 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 0.59 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 49.8 ttt180 . . . . . 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 3.32 110.738 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.784 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.0 m . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 110.021 -0.363 . . . . 0.38 110.021 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.784 ' H ' HG22 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 0.86 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.443 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 0.31 112.979 173.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 26.5 t-20 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.57 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 0.76 111.948 -175.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 1.9 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 0.33 108.655 170.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 0.42 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.26 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.642 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 0.4 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 0.54 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.606 ' H ' HG22 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 0.79 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.03 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 3.9 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.2 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 0.36 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 1.61 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.22 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.585 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.21 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.535 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 0.12 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.642 ' HA ' HG21 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 0.21 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.41 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.646 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 0.54 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.596 ' HE1' HG23 ' A' ' 40' ' ' VAL . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 0.44 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 0.57 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.761 ' HE2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.23 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.19 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.02 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 1.87 111.91 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.596 HG23 ' HE1' ' A' ' 34' ' ' TYR . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 0.59 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 3.32 110.117 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.546 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 110.637 -0.134 . . . . 0.38 110.637 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.546 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 0.86 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 0.31 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.504 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.57 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 0.76 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 1.9 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 0.33 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 0.42 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.26 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.629 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 0.4 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 0.54 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.735 HD23 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 0.79 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.03 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 3.9 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.2 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 0.36 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 1.61 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.22 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.651 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.651 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.21 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 0.12 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.735 ' OD1' HD23 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 0.21 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.41 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 0.54 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.561 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 0.44 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 0.57 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.23 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.19 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.467 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.02 114.077 -162.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 1.87 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.51 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 0.59 110.098 175.93 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.574 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.5 tmt_? . . . . . 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 3.32 109.37 -169.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.529 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 119.923 -0.084 . . . . 0.38 111.15 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 0.86 109.609 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 0.31 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 26.2 t-20 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.57 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 0.76 111.788 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 1.9 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 0.33 107.988 168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 0.42 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.26 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 0.4 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 0.54 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.55 ' H ' HG22 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 0.79 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.467 ' NH1' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.03 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 3.9 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.2 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 0.36 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 1.61 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.22 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.21 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.638 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 0.12 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HA ' HG21 ' A' ' 15' ' ' THR . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 0.21 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.641 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.41 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.793 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.664 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 0.54 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.629 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 0.44 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 0.57 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.793 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.23 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.19 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.02 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 1.87 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 0.59 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.641 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.4 tmt_? . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 3.32 110.543 -168.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.635 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.859 -0.115 . . . . 0.38 110.733 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 0.86 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.561 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 0.31 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 7' ' ' CYS . 27.4 t-20 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.57 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 0.76 112.687 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 1.9 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 0.33 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 0.42 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.26 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 28' ' ' CYS . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 0.4 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 0.79 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.03 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 3.9 110.151 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.2 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 0.36 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 1.61 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.22 110.975 -177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.427 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.21 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 0.12 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.567 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.487 ' ND2' HD23 ' A' ' 17' ' ' LEU . 36.9 t-20 -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 0.21 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.544 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.41 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 0.54 108.813 174.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.543 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 0.44 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 0.57 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.23 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.19 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.02 114.405 -165.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 1.87 111.351 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 0.59 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.543 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 3.32 110.83 -173.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.637 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 110.164 -0.31 . . . . 0.38 110.164 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.637 ' H ' HG22 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 0.86 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 0.31 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.2 t-20 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.57 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 0.76 112.058 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 1.9 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.421 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 0.33 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 5' ' ' THR . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 0.42 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.26 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.801 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 0.4 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 0.54 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 0.79 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.421 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.806 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.03 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 3.9 110.914 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.2 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 0.36 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 1.61 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.22 112.105 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.618 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.618 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.21 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.597 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 0.12 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.801 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD23 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 0.21 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.41 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.563 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 0.54 108.801 174.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HE1' HG23 ' A' ' 40' ' ' VAL . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 0.44 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 0.57 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.563 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.23 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.19 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG22 ' A' ' 40' ' ' VAL . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.02 114.559 -167.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 1.87 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.656 HG23 ' HE1' ' A' ' 34' ' ' TYR . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 0.59 110.131 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.638 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 3.32 109.445 -174.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.518 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.271 0.081 . . . . 0.38 111.03 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.465 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 0.86 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 0.31 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.494 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.57 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 0.76 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 1.9 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 0.33 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 0.42 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.26 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.622 HG21 ' HA ' ' A' ' 28' ' ' CYS . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 0.4 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 0.54 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.612 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 0.79 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.03 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 3.9 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.2 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 0.36 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 1.61 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.22 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.516 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.21 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 0.12 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' HG21 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.516 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 0.21 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.41 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.757 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 0.54 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 0.44 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 0.57 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.757 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.23 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.19 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.02 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 1.87 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.563 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 0.59 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.516 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 48.3 ttt180 . . . . . 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 3.32 110.38 -172.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.717 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.1 m . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 110.756 -0.091 . . . . 0.38 110.756 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.717 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 0.86 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 0.31 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.57 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 0.76 111.873 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 1.9 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 0.33 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.63 HG22 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 0.42 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.26 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 0.4 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 0.54 110.489 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 0.79 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.402 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.561 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.03 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.533 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 3.9 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.2 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 0.36 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 1.61 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.533 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.22 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.557 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.21 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 0.12 109.529 178.626 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.421 ' HB2' HD23 ' A' ' 17' ' ' LEU . 3.5 t30 -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 0.21 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.41 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.732 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.68 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 0.54 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HE1' HG23 ' A' ' 40' ' ' VAL . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 0.44 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 0.57 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.23 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.19 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.02 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 1.87 112.063 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 0.59 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.493 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 2.4 tmt_? . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 3.32 109.512 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.123 -0.325 . . . . 17.45 110.123 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -157.36 47.02 0.4 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.245 0.545 . . . . 15.75 110.363 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -71.37 133.95 46.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 15.5 110.387 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -154.74 156.99 37.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.021 -0.536 . . . . 14.5 110.04 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -86.88 73.96 9.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.785 0.326 . . . . 12.71 111.369 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -91.48 101.98 14.65 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.465 -0.568 . . . . 11.69 109.465 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -75.4 83.73 2.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.511 0.672 . . . . 9.77 110.757 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -70.56 -21.24 62.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 9.59 110.251 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 47.5 p -94.43 75.75 3.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.289 -0.414 . . . . 7.05 109.993 176.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.5 p -60.26 116.88 4.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.046 -0.525 . . . . 6.01 110.708 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 111.54 -21.5 21.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.82 -0.705 . . . . 2.88 111.791 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.461 HD22 ' N ' ' A' ' -7' ' ' LEU . 1.4 mm? -117.9 87.78 2.78 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.647 -0.871 . . . . 2.25 108.647 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -141.02 73.84 1.44 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.757 0.651 . . . . 3.44 112.757 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.825 ' HB ' HD12 ' A' ' 33' ' ' LEU . 1.5 p -129.18 118.44 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.077 -0.712 . . . . 1.67 109.077 170.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.31 38.92 3.07 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.069 0.462 . . . . 3.12 111.166 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.542 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.1 m-85 -110.3 169.41 8.76 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.151 -0.685 . . . . 2.17 109.151 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 20.2 tm0? 67.98 -82.19 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.058 0.762 . . . . 2.74 113.058 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -154.43 -170.83 20.7 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.685 -0.769 . . . . 1.43 112.885 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -93.73 -96.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.257 2.638 . . . . 2.08 114.537 -175.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -154.89 -171.64 3.91 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 111.958 0.355 . . . . 5.35 111.958 -171.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.427 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 50.7 ttt180 -151.29 9.35 0.56 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.303 -0.408 . . . . 2.94 110.815 -177.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 68.02 -99.15 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.82 1.045 . . . . 1.09 113.82 174.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.96 69.08 0.28 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 121.362 -0.447 . . . . 0.54 112.713 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.661 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -120.13 -172.73 2.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.761 0.781 . . . . 0.38 111.019 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.661 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 0.86 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 0.31 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.57 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 0.76 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 1.9 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 0.33 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 0.42 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.498 ' O ' HG23 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.26 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 0.4 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 0.54 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 0.79 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.427 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.499 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.03 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 3.9 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.2 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 0.36 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 1.61 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.518 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.22 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.524 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.524 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.21 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 0.12 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.567 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.519 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 0.21 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.41 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.603 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.825 HD12 ' HB ' ' A' ' -5' ' ' VAL . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 0.54 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 0.44 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.57 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.23 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.19 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.02 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 1.87 111.953 176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 0.59 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.554 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 20.0 ttt180 -94.13 108.7 37.53 Favored Pre-proline 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 3.32 110.693 -173.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.554 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 80.8 Cg_exo -53.89 118.48 5.0 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.137 1.891 . . . . 0.8 110.267 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 44' ' ' LEU . 3.4 tp -154.92 -72.95 0.12 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.565 -0.743 . . . . 1.8 110.74 -167.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.512 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.56 -156.74 0.77 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.547 -0.751 . . . . 3.21 109.466 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 46.9 ttm -80.76 -92.8 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.182 -0.607 . . . . 6.47 109.532 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -140.93 -31.39 0.6 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.795 -0.817 . . . . 10.6 108.795 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 tptt -126.27 71.64 1.28 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.518 -0.764 . . . . 10.22 108.941 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.512 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 42.7 mt-10 . . . . . 0 C--O 1.253 1.24 0 CA-C-N 115.449 -0.796 . . . . 7.0 110.829 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -18' ' ' MET . . . . . 0.419 ' O ' ' HB2' ' A' ' -14' ' ' HIS . 25.6 mmt . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.922 0.391 . . . . 17.45 110.575 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -29.75 34.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.165 0.507 . . . . 15.75 110.597 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -89.05 134.1 34.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.803 -0.635 . . . . 15.5 110.059 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 55.9 t60 58.07 47.74 14.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.587 0.708 . . . . 14.5 109.819 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -14' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' -18' ' ' MET . 49.7 t-80 -96.79 -44.39 7.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.563 -0.744 . . . . 12.71 110.624 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -151.55 -64.48 0.18 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.094 -0.503 . . . . 11.69 109.682 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -176.02 75.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.724 -0.671 . . . . 9.77 110.011 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -89.49 -36.31 15.47 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.498 -0.556 . . . . 9.59 109.498 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 22.5 t -80.77 137.82 36.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.909 -0.587 . . . . 7.05 109.603 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 5.1 p -86.94 40.99 0.94 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.081 0.467 . . . . 6.01 111.17 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 89.99 -158.76 27.24 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.998 -0.62 . . . . 2.88 111.847 -178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.571 ' O ' ' HG ' ' A' ' -7' ' ' LEU . 2.5 pt? -150.8 93.4 1.94 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.588 0.708 . . . . 2.25 110.638 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -155.62 105.24 2.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.806 -0.634 . . . . 3.44 110.465 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.602 ' HB ' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -153.75 96.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.466 0.65 . . . . 1.67 110.519 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' -4' ' ' LEU . . . . . 0.687 ' H ' HD23 ' A' ' -4' ' ' LEU . 2.5 pt? -88.99 11.21 18.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.99 -0.55 . . . . 3.12 111.1 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.509 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.6 m-85 -85.63 26.98 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.095 0.474 . . . . 2.17 110.334 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.404 ' HG2' ' HB3' ' A' ' 19' ' ' ARG . 6.0 tp-100 -165.2 -72.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.012 -0.54 . . . . 2.74 109.67 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 125.73 -78.44 0.37 Allowed Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.061 -1.066 . . . . 1.43 114.655 172.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -59.33 174.64 0.96 Allowed 'Trans proline' 0 N--CA 1.479 0.637 0 C-N-CA 123.955 3.104 . . . . 2.08 116.016 -166.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -146.18 -179.49 6.77 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.759 -1.564 . . . . 5.35 108.531 176.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.419 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 56.4 ttt180 -156.64 22.05 0.34 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.044 -0.663 . . . . 2.94 112.077 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.26 -89.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.244 1.202 . . . . 1.09 114.244 173.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.57 60.72 0.52 Allowed Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.089 -0.577 . . . . 0.54 112.825 -170.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.694 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -104.09 -169.14 1.59 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 117.045 0.423 . . . . 0.38 110.59 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.694 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 0.86 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.49 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.485 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 0.31 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.57 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 0.76 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 1.9 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 0.33 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 0.42 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.26 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.683 HG22 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 0.4 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 0.54 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.734 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 0.79 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.419 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.738 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.03 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 3.9 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.2 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 0.36 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 1.61 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.536 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.22 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.21 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 0.12 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.639 ' HA ' HG21 ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.677 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 0.21 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.41 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 0.54 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 0.44 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 0.57 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.23 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.19 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.448 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.02 113.991 -160.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 1.87 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 0.59 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.535 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -82.27 115.66 59.07 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 3.32 110.659 -175.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.6 Cg_exo -57.06 117.61 4.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.474 1.449 . . . . 0.8 108.948 165.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.9 tp -150.94 -73.46 0.16 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.633 -0.712 . . . . 1.8 110.865 -166.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 19.0 p -139.47 -159.49 0.96 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.175 -0.466 . . . . 3.21 110.209 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.449 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 5.7 tpt -98.74 -154.07 0.45 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.203 -1.036 . . . . 6.47 108.203 176.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 46' ' ' MET . 88.7 mttt -83.94 -30.39 26.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.38 0.61 . . . . 10.6 109.548 174.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -126.76 84.17 2.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 10.22 109.59 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 45' ' ' THR . 52.1 mm-40 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.173 -0.917 . . . . 7.0 111.234 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.977 0.418 . . . . 17.45 110.587 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -126.07 49.85 1.93 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.148 -0.478 . . . . 15.75 111.074 -177.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -58.98 109.44 0.83 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.513 . . . . 15.5 111.072 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.1 m80 57.54 25.45 11.56 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.742 -0.663 . . . . 14.5 111.316 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -103.45 21.04 16.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.647 0.737 . . . . 12.71 109.444 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -165.32 162.38 19.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.154 -0.93 . . . . 11.69 109.707 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -110.26 80.76 1.34 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.208 -0.664 . . . . 9.77 109.208 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -93.04 70.46 4.55 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.408 -0.815 . . . . 9.59 110.707 -172.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.9 m -64.83 -51.43 62.15 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.928 -0.767 . . . . 7.05 108.928 173.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 15.5 t -159.88 118.74 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.342 -0.844 . . . . 6.01 109.048 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -158.92 152.64 23.73 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.434 -0.666 . . . . 2.88 111.434 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.781 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -91.51 102.35 15.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.732 0.777 . . . . 2.25 112.103 -174.229 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -133.52 9.93 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.564 -0.744 . . . . 3.44 111.223 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.436 ' HB ' HD12 ' A' ' 33' ' ' LEU . 11.4 p -116.34 130.16 71.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.106 -0.331 . . . . 1.67 110.106 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 95.7 mt -131.53 33.66 4.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.983 0.421 . . . . 3.12 110.928 -178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -139.5 132.04 28.73 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.309 -0.405 . . . . 2.17 110.705 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 58.61 67.91 0.88 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.507 -0.769 . . . . 2.74 111.365 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLY . . . . . 0.432 ' HA3' ' HB3' ' A' ' 19' ' ' ARG . . . 167.78 116.48 0.36 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.696 -0.764 . . . . 1.43 113.024 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -89.88 -146.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.118 2.545 . . . . 2.08 112.514 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 91.9 mtm180 -122.74 -163.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.68 -0.489 . . . . 5.35 109.68 177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.532 ' HD2' ' OG1' ' A' ' 5' ' ' THR . 0.0 OUTLIER 179.44 -15.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.68 0.276 . . . . 2.94 110.558 -178.505 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.38 -94.08 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.618 0.97 . . . . 1.09 113.618 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.39 59.44 3.02 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.388 -0.434 . . . . 0.54 112.719 -172.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.703 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m -121.04 -176.84 3.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.368 0.584 . . . . 0.38 110.554 -176.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.611 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 0.86 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 0.31 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.568 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.2 t30 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.57 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.612 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 0.76 112.275 -175.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 1.9 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 0.33 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 0.42 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.26 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.559 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 0.4 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 0.54 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.559 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 0.79 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.432 ' HB3' ' HA3' ' A' ' -1' ' ' GLY . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.03 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.529 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 3.9 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.2 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 0.36 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 1.61 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.529 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.22 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.605 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.605 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.21 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.583 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 0.12 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.429 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.781 ' ND2' ' HA ' ' A' ' -7' ' ' LEU . 38.6 t-20 -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 0.21 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.583 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.41 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.767 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.798 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 0.54 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 0.44 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.57 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.23 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.798 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.19 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.452 ' O ' HG22 ' A' ' 40' ' ' VAL . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.02 114.084 -165.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 1.87 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 0.59 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.637 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.567 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -89.95 105.62 11.76 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 3.32 109.342 -174.286 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.637 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.1 Cg_exo -52.3 118.1 4.28 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 121.854 1.703 . . . . 0.8 110.121 176.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.612 HD23 ' SG ' ' A' ' 10' ' ' CYS . 3.9 tp -166.26 -71.5 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.284 -0.871 . . . . 1.8 109.706 -166.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER 50.76 -97.64 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.689 -1.141 . . . . 3.21 112.343 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.433 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 21.9 mmt -121.65 44.94 2.43 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.015 -0.539 . . . . 6.47 109.769 -177.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 70.81 -68.72 0.2 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.102 -0.953 . . . . 10.6 111.479 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -144.69 80.4 1.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.817 0.342 . . . . 10.22 111.307 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' HG2' ' HB2' ' A' ' 46' ' ' MET . 36.1 mm-40 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.645 -0.693 . . . . 7.0 109.984 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.096 0.474 . . . . 17.45 110.213 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -77.86 -11.06 59.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.153 -0.476 . . . . 15.75 111.849 -175.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -104.85 13.98 30.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.144 0.497 . . . . 15.5 110.84 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -139.6 115.96 10.56 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.319 -0.623 . . . . 14.5 109.319 175.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -118.05 8.3 12.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.753 0.311 . . . . 12.71 111.51 -174.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -142.9 109.41 5.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.392 0.615 . . . . 11.69 110.286 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -79.76 -77.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.403 -0.817 . . . . 9.77 110.751 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 67.0 150.66 0.06 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.614 0.721 . . . . 9.59 111.605 -177.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 17.3 m -86.03 51.74 2.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 7.05 110.806 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 37.9 m -138.6 33.01 2.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.75 -0.659 . . . . 6.01 109.894 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -92.52 -130.97 5.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.477 -0.783 . . . . 2.88 111.157 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.639 HD13 ' H ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -80.21 43.31 0.62 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.575 0.702 . . . . 2.25 110.872 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -88.9 -13.15 39.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.133 -0.94 . . . . 3.44 111.239 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.603 ' HB ' HD12 ' A' ' 33' ' ' LEU . 5.4 p -72.13 100.45 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.622 0.725 . . . . 1.67 110.457 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 24.2 tp -142.27 73.2 1.4 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.439 0.638 . . . . 3.12 110.223 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.54 -33.65 0.3 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.328 -0.851 . . . . 2.17 110.554 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.414 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 13.0 mm-40 -140.97 83.25 1.88 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 2.74 110.681 178.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 151.61 131.35 1.75 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 120.698 -0.763 . . . . 1.43 113.047 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -92.2 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 123.491 2.794 . . . . 2.08 112.86 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -130.95 -163.3 1.3 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.692 -0.484 . . . . 5.35 109.692 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -176.33 14.45 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.73 0.3 . . . . 2.94 111.717 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.89 -95.74 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.316 1.228 . . . . 1.09 114.316 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.12 57.23 0.6 Allowed Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.943 -0.646 . . . . 0.54 112.91 -170.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -97.07 -168.65 1.73 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.74 -0.271 . . . . 0.38 111.036 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.673 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 0.86 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.489 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 0.31 113.803 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.57 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.439 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 0.76 111.337 -171.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 1.9 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 0.33 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 0.42 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.26 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 0.4 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 0.54 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.699 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 0.79 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.03 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.542 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 3.9 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.2 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.702 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 0.36 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 1.61 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.542 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.22 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.21 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 0.12 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.653 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.511 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 0.21 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.526 ' SG ' HD11 ' A' ' 44' ' ' LEU . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.41 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.73 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 0.54 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 0.44 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.702 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 0.57 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.73 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.23 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.19 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.449 ' O ' HG22 ' A' ' 40' ' ' VAL . 34.2 m170 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.02 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 1.87 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 0.59 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.607 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.7 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.7 tmt_? -85.77 109.47 22.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 3.32 109.151 -174.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.79 118.93 5.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.011 1.808 . . . . 0.8 110.932 173.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 11.8 mt -121.69 -158.18 0.76 Allowed 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 109.143 -0.688 . . . . 1.8 109.143 -173.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.678 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 16.7 p -139.45 -157.76 0.8 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.9 -0.591 . . . . 3.21 110.27 -174.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 35.6 mtm -90.59 -163.3 1.0 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.901 -0.777 . . . . 6.47 108.901 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -70.93 -45.81 63.58 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.832 -0.803 . . . . 10.6 108.832 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmp? -92.01 49.92 1.6 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.536 -0.756 . . . . 10.22 111.046 176.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.678 ' O ' ' HB ' ' A' ' 45' ' ' THR . 44.3 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.338 -0.839 . . . . 7.0 111.72 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 90.9 mmm . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.76 0.314 . . . . 17.45 110.509 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -153.62 51.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.115 0.483 . . . . 15.75 110.076 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.92 66.3 4.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.013 -0.539 . . . . 15.5 110.484 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -118.42 21.78 12.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.351 0.596 . . . . 14.5 109.666 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 60.6 t60 -145.78 92.46 2.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.168 -0.924 . . . . 12.71 109.268 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -62.37 144.62 55.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.949 0.404 . . . . 11.69 110.74 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -119.31 119.27 33.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.182 -0.463 . . . . 9.77 110.17 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -79.41 75.49 6.01 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.774 -0.648 . . . . 9.59 110.049 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 37.6 m -84.85 103.13 13.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.876 -0.602 . . . . 7.05 110.619 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 24.7 m -131.08 61.4 1.64 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.037 -0.529 . . . . 6.01 110.244 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -71.92 -20.96 79.13 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.743 -0.662 . . . . 2.88 112.317 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.558 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 67.6 mt 67.19 71.35 0.36 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.11 0.564 . . . . 2.25 110.803 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -162.54 143.97 10.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 3.44 110.315 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.568 HG23 ' HG ' ' A' ' 33' ' ' LEU . 4.0 p -127.07 -12.97 3.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.499 -0.319 . . . . 1.67 110.4 177.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 75.52 -64.38 0.37 Allowed 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.335 0.654 . . . . 3.12 112.209 176.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 18.8 p90 -89.31 58.43 4.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.64 0.607 . . . . 2.17 112.64 -171.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.475 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 54.3 tp60 -177.96 120.8 0.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 2.74 109.396 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -76.53 123.78 6.88 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 121.005 -0.617 . . . . 1.43 113.342 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -95.51 156.36 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.532 2.821 . . . . 2.08 112.608 175.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -173.48 96.13 0.11 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.649 -0.251 . . . . 5.35 111.225 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.441 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 2.1 mtt180 164.7 156.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 2.94 108.781 177.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.71 -62.97 0.8 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.231 0.456 . . . . 1.09 112.231 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.25 56.59 3.2 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.936 -0.65 . . . . 0.54 112.106 -177.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.728 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m -119.96 -177.64 3.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.346 -0.502 . . . . 0.38 111.148 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.728 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 0.86 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 0.31 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.491 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.57 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 0.76 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 1.9 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 0.33 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 0.42 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.26 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 0.4 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 0.54 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.705 ' H ' HG22 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 0.79 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.407 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.634 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.03 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.519 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 3.9 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.2 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 0.36 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 1.61 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.22 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.497 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.21 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.41 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 0.12 109.293 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.615 HD21 HD13 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 0.21 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.41 111.661 -175.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 0.54 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.723 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 0.44 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 0.57 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.23 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.19 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.44 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.02 114.601 -161.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 1.87 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 38' ' ' HIS . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 0.59 109.914 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.689 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.723 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 -94.04 105.0 14.97 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 3.32 110.414 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.689 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.2 Cg_exo -62.47 119.43 6.52 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.314 2.009 . . . . 0.8 112.03 174.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.613 ' CD2' ' HG3' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -127.07 -96.05 0.43 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.212 -0.903 . . . . 1.8 110.499 177.426 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.3 m 67.82 -83.75 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.804 -1.089 . . . . 3.21 111.323 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.4 tpt -149.75 -66.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.073 0.463 . . . . 6.47 111.372 -179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 62.9 tttm -151.65 59.98 0.87 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.629 -0.714 . . . . 10.6 110.681 -174.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 43.87 49.08 7.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.613 0.968 . . . . 10.22 113.613 -177.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 47' ' ' LYS . 52.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 109.185 -0.672 . . . . 7.0 109.185 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 109.719 -0.474 . . . . 17.45 109.719 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -130.33 18.77 5.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.881 0.372 . . . . 15.75 111.296 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -82.2 107.65 15.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.892 0.377 . . . . 15.5 110.815 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -139.91 150.13 44.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.697 -0.683 . . . . 14.5 109.552 171.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -14' ' ' HIS . . . . . 0.465 ' O ' ' HB2' ' A' ' -13' ' ' HIS . 39.2 m80 71.4 126.02 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 O-C-N 124.127 0.892 . . . . 12.71 110.389 -176.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -13' ' ' HIS . . . . . 0.465 ' HB2' ' O ' ' A' ' -14' ' ' HIS . 52.5 m-70 71.77 117.06 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.626 -0.715 . . . . 11.69 111.525 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -99.51 155.17 17.71 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.924 -0.58 . . . . 9.77 110.023 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -77.3 72.69 3.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.084 0.469 . . . . 9.59 110.393 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.7 p -80.69 60.52 4.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.481 0.658 . . . . 7.05 110.379 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 41.3 m -145.5 133.09 20.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.55 -0.75 . . . . 6.01 110.174 -178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 171.07 -56.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 110.728 -0.949 . . . . 2.88 110.728 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.563 HD12 ' H ' ' A' ' -7' ' ' LEU . 1.1 mp -92.69 79.71 4.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.834 -1.173 . . . . 2.25 107.834 174.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.75 -83.27 0.4 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.987 -0.552 . . . . 3.44 111.686 -173.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.719 ' HB ' HD12 ' A' ' 33' ' ' LEU . 3.9 p 37.91 60.44 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 122.467 1.127 . . . . 1.67 110.653 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.09 43.4 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.165 -0.925 . . . . 3.12 113.086 -169.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.542 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 9.0 p90 -143.4 41.65 1.48 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.509 0.671 . . . . 2.17 110.368 177.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.625 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 7.5 tp-100 -172.34 160.09 4.87 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.073 -0.967 . . . . 2.74 108.857 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLY . . . . . 0.485 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . -41.34 127.11 3.57 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 123.825 0.703 . . . . 1.43 113.607 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 0' ' ' PRO . . . . . 0.485 ' HD3' ' HA2' ' A' ' -1' ' ' GLY . 24.1 Cg_exo -63.32 -75.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.232 2.621 . . . . 2.08 114.212 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 6.5 ppt_? -150.7 -174.73 4.86 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 112.373 0.509 . . . . 5.35 112.373 -173.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.75 17.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.267 -0.424 . . . . 2.94 110.859 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.55 -106.12 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.952 0.723 . . . . 1.09 112.952 175.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.96 74.24 0.25 Allowed Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.107 -1.044 . . . . 0.54 112.184 -174.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.715 ' O ' HG22 ' A' ' 13' ' ' THR . 0.7 OUTLIER -110.01 -172.68 2.09 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.818 -0.691 . . . . 0.38 109.926 -178.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.597 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 0.86 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.586 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 0.31 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.586 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.0 t30 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.57 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.579 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 0.76 112.513 -175.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.622 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 1.9 113.529 -172.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.432 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 0.33 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.715 HG22 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 0.42 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.26 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.65 HG21 ' HA ' ' A' ' 28' ' ' CYS . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 0.4 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 0.54 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.624 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 0.79 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.584 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.625 ' NH1' ' HB3' ' A' ' -2' ' ' GLN . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.03 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 3.9 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.2 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 0.36 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 1.61 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.22 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.499 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.21 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 0.12 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.65 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.529 ' ND2' ' HA ' ' A' ' -7' ' ' LEU . 38.6 t30 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 0.21 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.41 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.817 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 0.54 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.606 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 0.44 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 0.57 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.562 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.23 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.817 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.19 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.02 114.436 -166.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 1.87 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.434 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 0.59 109.768 175.58 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.626 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.606 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER -93.84 104.55 13.39 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 3.32 109.062 -174.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.626 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.2 Cg_exo -53.42 117.64 4.02 Favored 'Trans proline' 0 CA--C 1.511 -0.638 0 C-N-CA 121.622 1.548 . . . . 0.8 109.628 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' SG ' ' A' ' 10' ' ' CYS . 7.3 tp -153.33 -71.92 0.14 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.606 -0.725 . . . . 1.8 110.845 -166.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.9 p -134.8 -104.8 0.23 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.052 -0.522 . . . . 3.21 110.776 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.415 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 40.7 tpp -167.73 158.74 11.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.648 -0.871 . . . . 6.47 108.648 175.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 25.5 ttpp -47.91 -50.45 26.74 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.512 0.507 . . . . 10.6 110.547 -178.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -134.24 85.48 2.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.488 . . . . 10.22 109.861 173.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 46' ' ' MET . 42.6 tt0 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.417 -0.801 . . . . 7.0 110.076 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.871 0.367 . . . . 17.45 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.18 -74.56 0.2 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.909 -0.587 . . . . 15.75 110.397 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 45.9 m80 51.9 55.99 8.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.985 -0.552 . . . . 15.5 111.491 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -123.22 156.09 35.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.965 -0.562 . . . . 14.5 109.905 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 63.95 -87.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.587 0.554 . . . . 12.71 110.975 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 16.2 m-70 51.79 55.94 8.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.347 0.594 . . . . 11.69 111.62 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -93.59 75.21 4.39 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.647 -0.706 . . . . 9.77 109.67 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -76.87 -31.91 57.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 9.59 110.199 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 14.5 m -66.46 129.11 38.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 7.05 110.726 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 19.9 m -69.51 135.96 50.79 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.493 -0.558 . . . . 6.01 109.493 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -84.82 156.04 30.99 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.734 -0.746 . . . . 2.88 112.636 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' -7' ' ' LEU . 0.2 OUTLIER -74.74 78.91 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.357 0.598 . . . . 2.25 109.895 178.453 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -131.22 55.71 1.84 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.239 -0.891 . . . . 3.44 110.453 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.554 ' HB ' HD12 ' A' ' 33' ' ' LEU . 5.0 p -141.75 50.28 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.702 1.239 . . . . 1.67 109.2 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -80.58 3.16 22.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.881 -1.054 . . . . 3.12 111.908 -173.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -83.91 -12.48 55.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.655 -0.248 . . . . 2.17 111.237 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -162.56 113.5 1.53 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.539 0.209 . . . . 2.74 111.411 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 128.5 139.81 4.84 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.689 -0.767 . . . . 1.43 113.314 175.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 66.0 Cg_endo -92.47 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.339 2.693 . . . . 2.08 112.645 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -138.0 165.61 26.14 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.233 -0.654 . . . . 5.35 109.233 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.464 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 51.6 ttt180 -151.37 21.76 0.73 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.574 -0.45 . . . . 2.94 111.592 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.83 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.249 1.203 . . . . 1.09 114.249 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -122.96 53.03 0.75 Allowed Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.001 -0.619 . . . . 0.54 113.285 -169.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -89.07 -169.19 2.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.35 -0.241 . . . . 0.38 110.35 177.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.662 ' H ' HG22 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 0.86 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 0.31 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.4 t30 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.57 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 44' ' ' LEU . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 0.76 112.131 -175.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 1.9 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 0.33 109.271 173.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 0.42 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 0.4 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 0.54 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.676 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 0.79 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.464 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.03 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 3.9 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.2 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 0.36 113.349 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 1.61 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.22 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.467 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.21 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.563 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 0.12 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 0.21 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.716 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.41 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.721 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 0.54 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HE1' HG23 ' A' ' 40' ' ' VAL . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 0.44 111.414 -173.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 0.57 110.558 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.721 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.23 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.19 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.02 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.9 t30 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 1.87 111.972 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.593 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 0.59 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.585 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.716 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 -90.7 110.43 41.44 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 3.32 110.433 -174.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.585 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.9 Cg_exo -56.43 116.9 3.52 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.553 1.502 . . . . 0.8 109.199 169.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.528 HD23 ' SG ' ' A' ' 10' ' ' CYS . 3.0 tp -153.36 -85.25 0.07 Allowed 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.747 -0.66 . . . . 1.8 110.518 -168.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.4 ' H ' ' HB3' ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.83 -101.11 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.197 0.936 . . . . 3.21 112.474 -178.367 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 36.8 tpp -116.27 166.35 12.14 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.962 -0.755 . . . . 6.47 108.962 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -46.58 -42.49 16.09 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.289 0.368 . . . . 10.6 111.441 -176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -133.68 75.93 1.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.226 0.536 . . . . 10.22 110.388 172.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.684 -0.674 . . . . 7.0 109.19 176.056 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.6 mpp? . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.329 -0.249 . . . . 17.45 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.34 57.42 4.45 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.726 0.641 . . . . 15.75 111.954 177.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 66.2 m80 59.57 48.55 9.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.816 -0.629 . . . . 15.5 111.353 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -83.65 71.61 10.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.994 0.426 . . . . 14.5 110.201 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.98 132.3 46.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 12.71 110.257 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -81.3 133.35 35.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.157 -0.474 . . . . 11.69 110.948 -175.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -97.34 93.34 6.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 9.77 110.185 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -87.7 54.63 3.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.395 0.617 . . . . 9.59 109.97 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 20.4 m -82.71 75.32 9.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.842 -0.617 . . . . 7.05 110.219 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.4 m -84.33 10.27 11.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.694 -0.684 . . . . 6.01 110.58 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 113.08 -4.63 25.49 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.969 -0.852 . . . . 2.88 110.969 -174.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.643 ' HB2' HD22 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -162.93 146.81 11.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.204 -0.498 . . . . 2.25 110.477 178.003 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -143.65 -61.29 0.4 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.418 -0.355 . . . . 3.44 111.18 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.581 ' HB ' HD12 ' A' ' 33' ' ' LEU . 2.7 p -53.92 104.4 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.454 0.645 . . . . 1.67 112.07 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 2.1 pp -127.75 6.89 6.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.167 0.508 . . . . 3.12 110.774 177.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -88.14 -15.95 34.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 2.17 111.33 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -155.52 91.46 1.32 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.577 -0.283 . . . . 2.74 110.538 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 145.19 132.09 2.43 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.679 -0.772 . . . . 1.43 112.948 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -89.68 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.633 2.889 . . . . 2.08 112.507 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -134.63 150.77 50.7 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 110.189 -0.3 . . . . 5.35 110.189 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.535 ' HB3' ' OG1' ' A' ' 5' ' ' THR . 25.9 mmt180 -116.85 -17.55 10.42 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.321 -0.399 . . . . 2.94 110.657 -178.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.22 -111.56 0.06 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.62 0.768 . . . . 1.09 112.333 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.61 60.03 4.89 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 121.348 -0.453 . . . . 0.54 112.5 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.7 m -120.76 -179.54 4.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 117.122 0.461 . . . . 0.38 110.586 -174.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 0.86 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 0.31 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.57 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 0.76 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 1.9 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 0.33 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 0.42 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.26 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 0.4 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.54 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.643 HD22 ' HB2' ' A' ' -7' ' ' LEU . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 0.79 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.491 ' CG ' ' HB2' ' A' ' 2' ' ' ARG . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.03 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.64 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 3.9 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.2 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 0.36 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 1.61 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.22 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.21 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB2' HG21 ' A' ' 15' ' ' THR . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' A' ' -7' ' ' LEU . 0.6 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 0.21 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.41 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.714 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 0.54 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 0.44 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 0.57 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.23 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.19 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.02 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.5 t30 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 1.87 112.202 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.59 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.53 97.38 16.53 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 3.32 110.772 -167.694 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.663 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.5 Cg_exo -63.17 118.93 5.83 Favored 'Trans proline' 0 CA--C 1.507 -0.872 0 C-N-CA 122.604 2.203 . . . . 0.8 109.663 173.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.0 tp -165.57 -72.53 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 120.104 -0.638 . . . . 1.8 112.187 -165.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 5.2 p -146.14 -152.83 0.45 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.835 -0.62 . . . . 3.21 110.242 -174.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.412 ' H ' ' HB ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -95.54 -162.7 0.97 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.126 -0.694 . . . . 6.47 109.126 175.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -68.06 -28.34 67.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.161 0.505 . . . . 10.6 109.982 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -149.81 93.78 2.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.399 -0.818 . . . . 10.22 109.898 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' A' ' 45' ' ' THR . 4.0 mp0 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.41 -0.805 . . . . 7.0 110.739 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.0 ptm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.7 0.286 . . . . 17.45 110.333 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.14 114.68 6.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.173 -0.467 . . . . 15.75 110.114 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -76.49 113.05 13.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.301 -0.409 . . . . 15.5 110.032 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -88.75 93.99 9.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.984 -0.376 . . . . 14.5 109.984 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -58.13 132.87 54.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 12.71 110.325 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -81.16 117.75 21.98 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.968 -0.56 . . . . 11.69 110.889 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -12' ' ' HIS . . . . . 0.463 ' O ' ' HB2' ' A' ' -9' ' ' SER . 39.8 m-70 -74.48 -1.44 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.693 -0.685 . . . . 9.77 111.096 -176.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -64.32 -30.02 71.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.268 0.556 . . . . 9.59 109.522 170.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.2 m -93.48 47.43 1.24 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.738 -0.664 . . . . 7.05 109.827 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -9' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' -12' ' ' HIS . 13.5 t -86.5 -50.17 7.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.897 -0.592 . . . . 6.01 109.985 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -8' ' ' GLY . . . . . 0.423 ' HA3' HD11 ' A' ' -4' ' ' LEU . . . -104.71 163.56 14.61 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.536 -0.84 . . . . 2.88 111.717 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.462 ' CD1' ' HB ' ' A' ' 16' ' ' THR . 10.3 mp -86.04 41.45 0.92 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.869 0.366 . . . . 2.25 110.964 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.526 ' HG3' ' H ' ' A' ' -5' ' ' VAL . 6.7 tp10 61.55 -172.66 0.14 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.816 -0.629 . . . . 3.44 110.499 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.605 HG21 ' HA ' ' A' ' 33' ' ' LEU . 14.2 p 46.52 34.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 122.182 0.991 . . . . 1.67 111.676 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -4' ' ' LEU . . . . . 0.423 HD11 ' HA3' ' A' ' -8' ' ' GLY . 69.7 mt -82.01 83.89 7.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.516 -0.765 . . . . 3.12 110.815 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -164.16 -41.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 2.17 111.32 176.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -134.55 90.64 2.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.209 -0.196 . . . . 2.74 110.59 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 155.0 139.34 2.77 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.448 -0.882 . . . . 1.43 113.032 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -87.7 -159.89 0.1 OUTLIER 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.424 2.749 . . . . 2.08 112.638 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -142.26 168.05 20.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.592 . . . . 5.35 109.719 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.2 ttt-85 -158.89 176.11 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.858 -0.793 . . . . 2.94 108.858 -175.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.38 165.51 27.21 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.529 -0.468 . . . . 1.09 110.348 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.86 40.04 56.74 Favored Glycine 0 C--N 1.35 1.321 0 C-N-CA 121.099 -0.572 . . . . 0.54 113.108 -175.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.516 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m -121.06 170.56 9.41 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.822 0.311 . . . . 0.38 111.116 -173.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 0.86 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.485 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 0.31 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.57 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.521 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 0.76 112.308 -173.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 1.9 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 0.33 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 0.42 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.26 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.635 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 0.4 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.462 ' HB ' ' CD1' ' A' ' -7' ' ' LEU . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 0.54 111.584 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 0.79 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.03 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 3.9 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.2 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 0.36 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 1.61 108.196 -173.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.22 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.21 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 0.12 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.526 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.454 ' H ' HG21 ' A' ' 15' ' ' THR . 38.1 t-20 -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 0.21 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 44' ' ' LEU . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.41 111.614 -173.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.595 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.605 ' HA ' HG21 ' A' ' -5' ' ' VAL . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 0.54 109.585 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 0.44 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 0.57 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.23 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.19 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.02 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 1.87 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.411 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 0.59 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.525 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 tpt180 -82.99 115.61 59.78 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 3.32 110.154 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.525 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 60.6 Cg_exo -57.61 125.68 19.48 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.877 1.718 . . . . 0.8 110.747 168.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 6.4 mt -133.63 -144.02 0.22 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.537 -0.756 . . . . 1.8 109.174 -173.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 39.5 m 75.66 -55.31 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.754 0.659 . . . . 3.21 111.85 175.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 51.5 tpp -164.57 -62.57 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.405 -0.816 . . . . 6.47 110.497 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -167.95 48.24 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.659 -1.155 . . . . 10.6 109.427 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? 58.69 82.72 0.13 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.835 -0.62 . . . . 10.22 109.549 -171.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.616 -0.707 . . . . 7.0 110.146 -179.575 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.836 0.35 . . . . 17.45 110.633 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -96.63 48.42 1.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.955 0.407 . . . . 15.75 111.012 -178.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -138.5 143.98 39.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.151 -0.477 . . . . 15.5 109.76 177.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -113.39 63.69 0.64 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.676 0.75 . . . . 14.5 111.045 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -121.15 55.61 1.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.172 -0.922 . . . . 12.71 109.64 174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -91.35 -36.88 13.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.954 -0.566 . . . . 11.69 110.215 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -84.57 -38.66 19.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.708 -0.678 . . . . 9.77 109.667 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -89.99 103.86 16.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.757 -0.656 . . . . 9.59 109.946 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 30.6 m 66.61 -170.91 0.19 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.732 0.645 . . . . 7.05 110.587 -177.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 18.1 m 73.23 -53.73 0.7 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.339 0.655 . . . . 6.01 111.93 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -61.47 -24.46 63.87 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 121.587 -0.339 . . . . 2.88 113.411 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.683 ' H ' HD23 ' A' ' -7' ' ' LEU . 2.5 pt? -78.26 50.7 0.94 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.505 0.669 . . . . 2.25 111.062 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.04 -11.62 59.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.466 -0.788 . . . . 3.44 111.213 -175.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.536 ' HB ' HD12 ' A' ' 33' ' ' LEU . 7.4 p -76.02 85.0 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 122.059 0.933 . . . . 1.67 110.471 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.5 pp -95.81 21.98 7.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.703 -0.68 . . . . 3.12 111.46 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -129.83 146.85 51.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.464 -0.334 . . . . 2.17 111.102 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 53.89 68.79 0.79 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.802 -0.636 . . . . 2.74 111.908 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 170.88 140.31 2.99 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.182 -1.009 . . . . 1.43 113.498 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.04 -158.05 0.08 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 123.367 2.711 . . . . 2.08 112.007 175.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 -146.32 168.2 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.826 -0.435 . . . . 5.35 109.826 178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.487 ' HG3' ' H ' ' A' ' 3' ' ' ALA . 11.8 tpp180 -164.74 177.67 7.81 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.278 -1.008 . . . . 2.94 108.278 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.487 ' H ' ' HG3' ' A' ' 2' ' ' ARG . . . -144.62 165.89 26.75 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.309 -0.626 . . . . 1.09 109.309 171.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.37 43.64 51.95 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 120.584 -0.817 . . . . 0.54 112.401 -174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.88 177.82 4.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.865 0.333 . . . . 0.38 110.635 -175.144 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 0.86 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.427 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 0.31 113.4 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.52 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.57 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.498 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 0.76 111.775 -172.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 1.9 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 0.33 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 0.42 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.476 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.26 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.618 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 0.4 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 0.54 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.618 ' H ' HG22 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 0.79 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.03 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 3.9 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.2 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 0.36 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 1.61 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.22 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.52 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.21 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 0.12 109.09 177.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.465 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 0.21 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 44' ' ' LEU . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.41 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.74 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 0.54 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.425 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 0.44 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 0.57 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.23 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.19 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.02 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 1.87 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 0.59 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.59 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.658 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.0 tmt_? -81.02 110.72 18.89 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 3.32 109.192 -173.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.59 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.93 119.06 5.87 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 121.947 1.764 . . . . 0.8 111.07 174.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 7.5 mt -124.81 -143.49 0.31 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.032 -0.531 . . . . 1.8 109.792 -173.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.594 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.86 -138.41 0.2 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.672 -0.862 . . . . 3.21 108.672 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.1 mtm -91.1 -179.62 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 118.066 0.394 . . . . 6.47 110.382 174.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.27 -40.76 82.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.36 -0.607 . . . . 10.6 109.36 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -122.61 71.02 1.01 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.622 -0.717 . . . . 10.22 110.579 173.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.594 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 27.8 mt-10 . . . . . 0 C--O 1.252 1.233 0 CA-C-O 118.705 -0.664 . . . . 7.0 111.491 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 111.529 0.196 . . . . 17.45 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -93.04 25.35 3.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.925 0.343 . . . . 15.75 111.925 -175.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -116.71 27.36 9.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.886 0.374 . . . . 15.5 110.358 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -84.69 143.33 29.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 14.5 110.861 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -159.23 124.84 4.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.779 -0.646 . . . . 12.71 109.874 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -85.28 74.29 10.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.148 -0.478 . . . . 11.69 111.305 -176.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -87.89 136.54 32.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.962 -0.755 . . . . 9.77 108.962 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -78.06 72.52 4.6 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.177 0.513 . . . . 9.59 110.96 -175.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 38.7 m -137.86 40.51 2.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.825 -0.625 . . . . 7.05 110.483 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 32.0 t -127.5 102.33 6.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.989 0.423 . . . . 6.01 111.318 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 76.39 72.29 1.11 Allowed Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.818 -0.628 . . . . 2.88 113.524 173.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.525 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 3.1 mp -122.29 57.7 1.07 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 2.25 110.699 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -149.86 89.36 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.701 -0.681 . . . . 3.44 110.67 172.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.703 ' HB ' HD12 ' A' ' 33' ' ' LEU . 6.2 p -136.17 119.95 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.852 -0.796 . . . . 1.67 108.852 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.3 tt -90.31 -50.59 5.89 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.904 0.383 . . . . 3.12 110.852 -172.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.15 136.03 46.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.467 0.543 . . . . 2.17 112.467 -172.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 59.73 71.81 0.56 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 114.906 -1.043 . . . . 2.74 112.99 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLY . . . . . 0.423 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . 165.58 115.87 0.34 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 119.903 -1.141 . . . . 1.43 113.69 177.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -88.91 -151.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.323 2.682 . . . . 2.08 112.64 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 42.7 mtm180 -124.57 -174.06 2.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.332 -0.395 . . . . 5.35 110.053 177.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -169.02 21.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.086 0.47 . . . . 2.94 110.936 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.91 -100.35 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.017 1.117 . . . . 1.09 114.017 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.42 61.95 0.37 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.102 -0.571 . . . . 0.54 113.028 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -100.48 -169.64 1.75 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.202 0.501 . . . . 0.38 110.634 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.693 ' H ' HG22 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 0.86 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 0.31 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.574 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.8 t30 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.57 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' HD23 ' A' ' 44' ' ' LEU . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 0.76 111.953 -175.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 1.9 113.772 -171.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 0.33 108.911 171.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 0.42 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.26 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 0.4 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 0.54 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.629 ' H ' HG22 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 0.79 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.453 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.509 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.03 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.7 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 3.9 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' ASP . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.2 109.042 171.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 0.36 113.99 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 1.61 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.22 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.7 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.21 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.12 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.555 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.525 ' CG ' ' HA ' ' A' ' -7' ' ' LEU . 38.9 t-20 -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 0.21 113.416 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.41 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.729 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.703 HD12 ' HB ' ' A' ' -5' ' ' VAL . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 0.54 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 0.44 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.57 111.383 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.23 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.19 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.02 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 1.87 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 0.59 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.574 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 58.3 ttt180 -88.42 110.02 33.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 3.32 110.872 -173.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.5 Cg_exo -55.5 117.76 4.42 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.431 1.421 . . . . 0.8 109.308 172.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.654 HD23 ' SG ' ' A' ' 10' ' ' CYS . 8.2 tp -156.51 -73.54 0.1 Allowed 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.983 -0.553 . . . . 1.8 111.248 -165.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -140.86 -155.55 0.6 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.996 -0.547 . . . . 3.21 109.763 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.465 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 28.6 tpp -136.56 -142.38 0.17 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.113 0.415 . . . . 6.47 109.992 -178.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 46' ' ' MET . 76.7 tttt -83.17 58.03 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.834 0.35 . . . . 10.6 110.397 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 54.54 85.69 0.06 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.576 -0.738 . . . . 10.22 110.913 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.353 -0.832 . . . . 7.0 110.263 -177.933 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.883 -0.043 . . . . 17.45 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.69 84.44 0.1 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.547 0.529 . . . . 15.75 110.452 -176.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.7 m80 62.01 -156.05 0.34 Allowed 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.08 -0.711 . . . . 15.5 109.08 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 70.3 m80 61.67 40.69 12.95 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.115 0.484 . . . . 14.5 110.147 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -75.87 97.13 3.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.876 -0.602 . . . . 12.71 111.192 -177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -65.87 115.76 6.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.081 -0.711 . . . . 11.69 109.081 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -65.38 101.15 0.54 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.139 0.495 . . . . 9.77 111.132 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -105.28 136.03 45.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.712 -0.676 . . . . 9.59 110.22 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 8.6 t 65.03 -171.32 0.19 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.688 0.617 . . . . 7.05 110.015 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -9' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' -6' ' ' GLU . 24.1 m 56.38 55.42 6.61 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.064 0.459 . . . . 6.01 110.674 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -75.73 -11.37 84.57 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 121.009 -0.615 . . . . 2.88 112.997 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.57 ' HB3' HD21 ' A' ' 29' ' ' ASN . 14.9 mt -122.72 78.39 1.53 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.84 -0.43 . . . . 2.25 109.84 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' -9' ' ' SER . 24.6 mt-10 -113.47 -83.6 0.6 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.916 -0.314 . . . . 3.44 111.752 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 33' ' ' LEU . 7.3 p 38.7 56.55 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-O 122.285 1.04 . . . . 1.67 111.89 178.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 46.0 tp -87.07 60.62 6.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.156 -0.929 . . . . 3.12 110.686 -175.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -160.52 33.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.069 -0.514 . . . . 2.17 111.225 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -139.53 -57.35 0.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 2.74 111.384 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 175.57 -178.41 47.16 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.284 -0.96 . . . . 1.43 113.056 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.06 -148.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.383 2.722 . . . . 2.08 112.897 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.424 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 5.0 ptm180 -114.4 -164.6 0.94 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.277 -0.268 . . . . 5.35 110.277 177.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.497 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 65.2 ttt180 -151.12 34.32 0.58 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.491 0.662 . . . . 2.94 110.026 -177.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.79 -104.16 0.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.338 0.866 . . . . 1.09 113.338 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.59 52.83 0.77 Allowed Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.967 -0.635 . . . . 0.54 112.905 -172.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -80.75 -169.36 2.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.582 0.191 . . . . 0.38 111.09 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.702 ' H ' HG22 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 0.86 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.575 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 0.31 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.575 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.6 t30 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.57 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.633 ' SG ' HD23 ' A' ' 44' ' ' LEU . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 0.76 112.188 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 1.9 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 0.33 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 0.42 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.26 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.623 HG21 ' HA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.4 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 0.54 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.654 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 0.79 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.497 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.03 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.704 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 3.9 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.422 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.2 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 0.36 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 1.61 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.532 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.22 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.704 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.21 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 0.12 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.57 HD21 ' HB3' ' A' ' -7' ' ' LEU . 34.2 t-20 -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 0.21 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.41 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.585 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.717 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 0.54 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.511 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 0.44 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.495 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 0.57 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.23 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.19 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.02 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 1.87 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 0.59 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.62 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -89.62 107.99 22.26 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 3.32 109.777 -172.601 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.8 Cg_exo -55.09 116.88 3.45 Favored 'Trans proline' 0 CA--C 1.509 -0.733 0 C-N-CA 121.687 1.592 . . . . 0.8 109.303 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.633 HD23 ' SG ' ' A' ' 10' ' ' CYS . 10.6 tp -162.24 -69.85 0.05 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.896 -0.593 . . . . 1.8 111.178 -164.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.9 p -142.33 -156.95 0.73 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.417 -0.81 . . . . 3.21 108.907 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.8 tpt -140.37 155.77 46.65 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 6.47 109.817 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -42.44 -49.11 5.28 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.953 0.783 . . . . 10.6 111.435 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -131.95 72.95 1.51 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.506 -0.316 . . . . 10.22 110.794 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 116.06 -0.518 . . . . 7.0 111.721 173.28 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 46.0 tpp . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.629 0.252 . . . . 17.45 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -70.4 97.2 1.23 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.944 0.402 . . . . 15.75 111.897 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -109.46 -39.25 5.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.179 -0.464 . . . . 15.5 110.587 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -112.94 59.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.355 -0.384 . . . . 14.5 109.992 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 63.3 m80 62.91 -110.34 0.33 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.91 -0.587 . . . . 12.71 110.254 -173.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 63.1 m80 64.92 -71.59 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.058 0.543 . . . . 11.69 111.171 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -91.24 126.08 36.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.253 -0.43 . . . . 9.77 109.918 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -82.52 80.62 8.61 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.414 -0.588 . . . . 9.59 109.414 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 5.8 m -78.52 89.9 4.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.602 -0.726 . . . . 7.05 109.903 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 62.9 m -56.44 95.23 0.02 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.609 0.568 . . . . 6.01 111.617 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -8' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' -7' ' ' LEU . . . -90.99 68.65 2.24 Favored Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 110.327 -1.109 . . . . 2.88 110.327 174.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' -8' ' ' GLY . 0.3 OUTLIER 78.64 119.49 0.05 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.039 0.923 . . . . 2.25 110.34 -174.23 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.566 ' HG2' ' H ' ' A' ' -5' ' ' VAL . 20.5 tt0 -157.61 -145.19 0.14 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.032 -1.44 . . . . 3.44 107.269 -170.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.682 ' HB ' HD12 ' A' ' 33' ' ' LEU . 4.8 p 50.97 -67.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 C-N-CA 125.152 1.381 . . . . 1.67 114.57 176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -4' ' ' LEU . . . . . 0.56 ' H ' HG13 ' A' ' -5' ' ' VAL . 55.5 tp 79.24 -60.58 0.35 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.82 1.045 . . . . 3.12 113.82 171.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -51.7 -77.6 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.345 1.239 . . . . 2.17 114.345 -166.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -95.37 83.68 3.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.746 -0.596 . . . . 2.74 111.503 -173.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 150.79 119.01 0.87 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 1.43 112.708 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -85.99 -147.97 0.03 OUTLIER 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.609 2.873 . . . . 2.08 112.447 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.659 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 24.6 ptt180 -134.26 179.21 6.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.797 -0.183 . . . . 5.35 110.911 176.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.473 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 51.7 ttt180 -159.66 31.58 0.19 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.714 0.292 . . . . 2.94 111.483 -172.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.43 -106.99 0.35 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.502 0.927 . . . . 1.09 113.502 175.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.26 79.29 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.389 -0.91 . . . . 0.54 112.309 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.689 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m -110.55 -173.21 2.19 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.576 -0.812 . . . . 0.38 109.456 177.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.66 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 0.86 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 0.31 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.57 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.725 ' HB2' ' OG1' ' A' ' 45' ' ' THR . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 0.76 112.189 -175.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 1.9 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 0.33 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.689 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 0.42 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.503 ' O ' HG23 ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.26 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.66 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 0.4 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 0.54 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.66 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 0.79 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.659 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.03 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.561 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 3.9 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.2 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 0.36 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 1.61 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.22 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.21 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 0.12 109.52 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.485 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.615 ' HB2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 0.21 113.038 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.41 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.756 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.682 HD12 ' HB ' ' A' ' -5' ' ' VAL . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 0.54 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 0.44 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 0.57 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.756 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.23 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.19 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.479 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.02 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 1.87 112.093 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 0.59 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.605 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.441 ' HD3' HD22 ' A' ' 44' ' ' LEU . 49.8 ttt180 -82.02 111.49 27.51 Favored Pre-proline 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 3.32 110.738 -171.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.605 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 64.4 Cg_exo -56.79 117.87 4.62 Favored 'Trans proline' 0 CA--C 1.508 -0.786 0 C-N-CA 121.608 1.539 . . . . 0.8 108.809 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD22 ' HD3' ' A' ' 42' ' ' ARG . 11.7 tp -166.13 -74.68 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.689 -0.687 . . . . 1.8 110.551 -164.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 10' ' ' CYS . 16.3 p -150.3 -165.02 2.16 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.118 -1.067 . . . . 3.21 108.118 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 47.6 ttm -168.97 -75.28 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 118.907 0.776 . . . . 6.47 110.979 -175.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -141.71 46.7 1.67 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.923 -1.035 . . . . 10.6 108.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.4 mttp 53.26 78.15 0.15 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.909 -1.042 . . . . 10.22 110.596 -172.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.521 -0.752 . . . . 7.0 110.409 -174.976 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 121.01 0.433 . . . . 17.45 110.145 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -133.61 -63.36 0.75 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 15.75 109.777 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 19.0 t60 59.52 67.78 0.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 15.5 111.098 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -129.32 20.13 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.602 -0.726 . . . . 14.5 110.092 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -102.97 13.42 34.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 12.71 111.098 -176.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -71.08 -47.01 60.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.637 0.256 . . . . 11.69 110.754 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -131.95 -43.16 0.98 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.89 -0.324 . . . . 9.77 111.016 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -60.14 -42.06 94.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.968 0.413 . . . . 9.59 110.798 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.1 m -124.38 53.1 1.46 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.135 -0.484 . . . . 7.05 109.943 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 20.8 t -63.0 -47.92 81.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.998 -0.546 . . . . 6.01 110.07 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 170.87 -70.02 0.13 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.484 -0.865 . . . . 2.88 112.506 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.599 ' H ' HD23 ' A' ' -7' ' ' LEU . 0.4 OUTLIER -95.09 59.64 2.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.312 0.577 . . . . 2.25 110.97 -174.424 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -86.67 49.99 1.91 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.614 -0.721 . . . . 3.44 111.087 -175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.534 HG23 ' CE1' ' A' ' -3' ' ' PHE . 6.0 p -148.37 122.18 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 1.67 110.782 -177.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 26.4 tp -145.55 57.31 1.24 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.997 0.427 . . . . 3.12 111.05 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.534 ' CE1' HG23 ' A' ' -5' ' ' VAL . 42.5 p90 -145.69 31.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.329 0.492 . . . . 2.17 112.329 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -177.98 61.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.757 0.28 . . . . 2.74 111.757 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 122.83 130.45 3.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.51 -0.852 . . . . 1.43 112.501 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -84.41 -64.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.58 2.186 . . . . 2.08 113.495 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.514 ' HG2' ' H ' ' A' ' 2' ' ' ARG . 68.2 ttt180 -175.49 177.69 1.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.567 -0.901 . . . . 5.35 108.567 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.514 ' H ' ' HG2' ' A' ' 1' ' ' ARG . 23.6 ttt180 -164.22 22.71 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.239 0.543 . . . . 2.94 110.532 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.405 ' H ' ' HG2' ' A' ' 1' ' ' ARG . . . 52.11 -99.39 0.08 Allowed 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.958 1.096 . . . . 1.09 113.958 176.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.14 60.22 0.4 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 121.146 -0.55 . . . . 0.54 112.995 -170.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.784 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.0 m -102.62 -171.13 1.9 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.167 0.483 . . . . 0.38 110.021 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.784 ' H ' HG22 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 0.86 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.443 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 0.31 112.979 173.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.3 t30 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.57 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.625 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 0.76 111.948 -175.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 1.9 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 0.33 108.655 170.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 0.42 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.26 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.642 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 0.4 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 0.54 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' H ' HG22 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 0.79 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.03 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 3.9 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.2 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 0.36 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 1.61 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.22 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.585 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.21 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.535 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 0.12 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.642 ' HA ' HG21 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 0.21 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.41 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.646 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 0.54 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.596 ' HE1' HG23 ' A' ' 40' ' ' VAL . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 0.44 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 0.57 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.761 ' HE2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.23 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.19 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.02 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 1.87 111.91 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.596 HG23 ' HE1' ' A' ' 34' ' ' TYR . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 0.59 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.603 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 -95.44 106.89 29.42 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 3.32 110.117 -174.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.603 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 51.7 Cg_exo -57.5 117.23 3.89 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 121.574 1.516 . . . . 0.8 108.737 170.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.625 HD23 ' SG ' ' A' ' 10' ' ' CYS . 11.9 tp -159.28 -73.62 0.08 Allowed 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.823 -0.626 . . . . 1.8 111.88 -162.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.447 ' HB ' ' H ' ' A' ' 46' ' ' MET . 17.1 p -140.69 -152.07 0.39 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.74 -0.664 . . . . 3.21 109.902 -176.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.447 ' H ' ' HB ' ' A' ' 45' ' ' THR . 43.3 tpp -142.86 168.18 20.33 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.53 -0.544 . . . . 6.47 109.53 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -44.49 -53.47 6.95 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.768 0.668 . . . . 10.6 111.387 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -132.78 84.07 2.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.359 -0.608 . . . . 10.22 109.359 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.441 -0.79 . . . . 7.0 109.468 179.25 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 60.7 ttp . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.845 0.355 . . . . 17.45 110.386 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -17' ' ' ALA . . . . . 0.502 ' HB3' ' HB3' ' A' ' -14' ' ' HIS . . . -136.67 109.61 7.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.104 -0.498 . . . . 15.75 110.136 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -67.57 -25.74 65.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 15.5 111.309 -176.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.26 63.96 1.16 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.351 -0.611 . . . . 14.5 109.351 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -14' ' ' HIS . . . . . 0.502 ' HB3' ' HB3' ' A' ' -17' ' ' ALA . 19.7 p-80 -86.79 139.98 30.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.786 -0.643 . . . . 12.71 110.703 -178.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -176.11 -37.78 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.826 -0.625 . . . . 11.69 109.332 -177.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 67.91 -76.3 0.06 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 114.964 -1.016 . . . . 9.77 111.364 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -149.91 -59.79 0.2 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.577 -0.527 . . . . 9.59 109.577 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 25.3 m 64.27 98.36 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.783 0.677 . . . . 7.05 112.207 175.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -9' ' ' SER . . . . . 0.426 ' HA ' ' OE2' ' A' ' -6' ' ' GLU . 67.7 m -147.37 79.02 1.49 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.559 -0.746 . . . . 6.01 109.682 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.12 -126.79 4.29 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.918 -0.658 . . . . 2.88 112.296 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.584 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -86.37 72.62 10.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.703 0.763 . . . . 2.25 111.464 -177.448 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.426 ' OE2' ' HA ' ' A' ' -9' ' ' SER . 36.4 mt-10 -104.73 29.95 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 3.44 111.774 -175.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.474 HG12 HD21 ' A' ' 29' ' ' ASN . 4.3 p -127.81 127.68 68.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.905 -0.406 . . . . 1.67 109.905 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.9 pp -115.28 19.66 15.42 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.409 0.522 . . . . 3.12 112.409 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.427 ' O ' ' HB2' ' A' ' -2' ' ' GLN . 17.2 p90 -134.69 106.32 6.89 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.62 -0.432 . . . . 2.17 111.727 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.506 ' OE1' ' HB2' ' A' ' 20' ' ' ARG . 7.1 tp-100 158.57 -74.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.663 1.185 . . . . 2.74 110.51 170.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -137.34 160.21 25.0 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.545 -0.836 . . . . 1.43 112.625 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -84.72 -67.31 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.352 2.701 . . . . 2.08 113.47 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -172.33 -178.71 2.09 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.296 0.238 . . . . 5.35 110.494 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -161.89 -12.18 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.696 -0.229 . . . . 2.94 111.051 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.03 -100.53 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.235 0.828 . . . . 1.09 113.235 171.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.23 57.46 2.06 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.363 -0.446 . . . . 0.54 112.762 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.546 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -112.9 -176.5 2.91 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.279 -0.541 . . . . 0.38 110.637 -176.569 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.546 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 0.86 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 0.31 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.504 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.57 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 0.76 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 1.9 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 0.33 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 0.42 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.26 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.629 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 0.4 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 0.54 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.735 HD23 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 0.79 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.03 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 3.9 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.2 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 0.36 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 1.61 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.22 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.651 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.651 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.21 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 0.12 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.735 ' OD1' HD23 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 0.21 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.41 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 0.54 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.561 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 0.44 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 0.57 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.23 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.19 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.467 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.02 114.077 -162.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 1.87 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.51 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 0.59 110.098 175.93 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.593 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.704 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.5 tmt_? -94.77 108.25 36.29 Favored Pre-proline 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 3.32 109.37 -169.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.593 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.9 Cg_exo -55.12 119.75 7.04 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.026 1.817 . . . . 0.8 110.841 173.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 9.2 mt -124.45 -147.29 0.37 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.811 -0.631 . . . . 1.8 110.138 -172.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.408 ' HB ' ' H ' ' A' ' 46' ' ' MET . 13.3 p -135.37 -149.03 0.32 Allowed 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.861 -0.792 . . . . 3.21 108.861 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.408 ' H ' ' HB ' ' A' ' 45' ' ' THR . 63.2 mmm -102.25 -158.59 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.103 -0.702 . . . . 6.47 109.103 176.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -88.7 80.28 7.29 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.226 0.536 . . . . 10.6 110.636 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 tttm 55.5 86.4 0.06 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 114.532 -1.213 . . . . 10.22 112.329 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.911 -0.566 . . . . 7.0 109.651 174.657 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.091 -0.337 . . . . 17.45 110.091 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -106.82 52.15 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.167 0.508 . . . . 15.75 110.469 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -16' ' ' HIS . . . . . 0.63 ' HB3' ' O ' ' A' ' -12' ' ' HIS . 33.3 m80 -98.13 -74.12 0.59 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.815 -0.63 . . . . 15.5 109.609 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 52.0 m80 64.76 168.23 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.734 0.646 . . . . 14.5 111.567 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 t60 59.39 56.9 3.56 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.025 -0.534 . . . . 12.71 110.375 178.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 34.8 t60 70.83 -69.71 0.17 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.355 -0.839 . . . . 11.69 110.633 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -12' ' ' HIS . . . . . 0.63 ' O ' ' HB3' ' A' ' -16' ' ' HIS . 10.5 t60 -126.15 -50.45 1.55 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.458 -0.942 . . . . 9.77 108.458 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -178.23 -62.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.213 -0.903 . . . . 9.59 108.945 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 57.6 m -157.9 92.91 1.22 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.522 -0.763 . . . . 7.05 109.198 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 25.1 m 66.07 88.49 0.11 Allowed 'General case' 0 CA--C 1.53 0.186 0 O-C-N 123.69 0.619 . . . . 6.01 110.231 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -102.36 -149.25 21.75 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.668 -0.777 . . . . 2.88 111.733 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.624 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 4.2 mp -81.9 56.35 3.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.5 0.667 . . . . 2.25 109.717 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -114.08 62.97 0.66 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.354 -0.839 . . . . 3.44 111.331 -173.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.48 ' HB ' HD12 ' A' ' 33' ' ' LEU . 2.5 p -142.18 100.02 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.433 0.635 . . . . 1.67 110.555 178.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 32.4 tp -136.27 55.99 1.83 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.99 -0.55 . . . . 3.12 110.405 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.44 ' CE1' HG23 ' A' ' -5' ' ' VAL . 32.8 p90 -131.21 6.11 4.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.362 -0.381 . . . . 2.17 111.565 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 177.51 82.59 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.427 -0.351 . . . . 2.74 110.475 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 149.77 156.94 7.46 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.294 -0.955 . . . . 1.43 113.57 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -96.48 -159.16 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.964 3.11 . . . . 2.08 112.6 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -146.6 -178.66 6.29 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.3 -0.409 . . . . 5.35 110.668 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.494 ' O ' ' HD1' ' A' ' 18' ' ' TRP . 64.5 ttt-85 -166.32 -178.81 4.7 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.914 -1.143 . . . . 2.94 107.914 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.486 ' H ' ' HG2' ' A' ' 2' ' ' ARG . . . -118.04 -78.12 0.58 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.624 1.102 . . . . 1.09 112.587 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.8 65.34 4.14 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.234 -0.508 . . . . 0.54 112.729 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.529 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -121.0 177.96 4.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.723 0.761 . . . . 0.38 111.15 -176.042 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 0.86 109.609 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 0.31 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 6.5 t30 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.57 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 0.76 111.788 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 1.9 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 0.33 107.988 168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 0.42 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.26 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 0.4 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 0.54 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.55 ' H ' HG22 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 0.79 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.03 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 3.9 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.2 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 0.36 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 1.61 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.22 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.21 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.638 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 0.12 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HA ' HG21 ' A' ' 15' ' ' THR . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.624 ' CG ' ' HA ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 0.21 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.641 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.41 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.793 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.664 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 0.54 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.629 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 0.44 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 0.57 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.793 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.23 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.19 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.02 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 1.87 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 0.59 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.571 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.641 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.4 tmt_? -96.77 109.23 47.6 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 3.32 110.543 -168.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.2 Cg_exo -59.48 145.36 98.2 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 121.925 1.75 . . . . 0.8 110.4 171.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.54 HD11 ' ND2' ' A' ' 9' ' ' ASN . 0.9 OUTLIER -142.37 -90.94 0.13 Allowed 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.483 -0.487 . . . . 1.8 110.852 -169.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 46' ' ' MET . 6.1 p -163.09 -155.52 0.34 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.922 -1.14 . . . . 3.21 107.922 -177.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.431 ' H ' ' HB ' ' A' ' 45' ' ' THR . 75.8 mmm -105.91 65.46 0.7 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.618 -0.882 . . . . 6.47 108.618 172.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 65.31 31.91 10.22 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 114.987 -1.006 . . . . 10.6 111.132 -176.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 tttm 53.99 84.96 0.06 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.754 -1.112 . . . . 10.22 112.832 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 C--O 1.25 1.089 0 CA-C-N 115.871 -0.604 . . . . 7.0 111.252 174.983 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.34 -0.245 . . . . 17.45 110.34 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -74.57 -26.77 60.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.418 0.628 . . . . 15.75 110.268 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -118.25 93.18 4.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.397 -0.819 . . . . 15.5 109.741 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -134.36 96.82 3.67 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.692 -0.685 . . . . 14.5 110.38 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -64.33 154.58 34.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 12.71 111.165 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.1 m170 60.12 81.66 0.17 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.773 -0.649 . . . . 11.69 111.866 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -134.56 40.21 2.99 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 9.77 110.572 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -11' ' ' HIS . . . . . 0.487 ' HA ' ' CD ' ' A' ' -6' ' ' GLU . 28.8 m80 59.95 63.66 1.41 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.342 -0.844 . . . . 9.59 110.066 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.2 m -93.81 -69.64 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.587 -0.733 . . . . 7.05 111.857 -173.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 12.8 p -148.77 24.56 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.713 0.292 . . . . 6.01 111.549 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.61 -159.39 34.48 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.432 -0.889 . . . . 2.88 111.715 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.447 HD22 ' N ' ' A' ' -7' ' ' LEU . 1.1 mm? -89.68 70.7 7.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.124 -1.065 . . . . 2.25 108.124 175.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.487 ' CD ' ' HA ' ' A' ' -11' ' ' HIS . 31.4 mt-10 -126.02 67.33 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 3.44 111.944 -168.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.782 ' HB ' HD12 ' A' ' 33' ' ' LEU . 4.8 p -111.79 106.34 20.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 1.67 108.897 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -93.32 46.0 1.19 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.259 0.466 . . . . 3.12 112.259 -169.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.537 ' O ' ' HB3' ' A' ' -2' ' ' GLN . 5.0 p90 -176.43 175.8 1.72 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.474 -0.33 . . . . 2.17 110.735 177.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.537 ' HB3' ' O ' ' A' ' -3' ' ' PHE . 5.7 tp60 91.65 -73.56 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.005 1.322 . . . . 2.74 112.07 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -168.32 -166.59 27.64 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 119.262 -1.447 . . . . 1.43 114.116 -175.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' PRO . . . . . 0.419 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 52.3 Cg_endo -94.02 -141.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.858 3.038 . . . . 2.08 112.837 -176.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 15.2 ptp180 -116.19 -169.39 1.6 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.476 -0.329 . . . . 5.35 110.217 177.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.449 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 17.5 ttm180 -151.71 16.55 0.69 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.522 0.677 . . . . 2.94 109.98 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.6 -100.93 0.08 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.563 0.949 . . . . 1.09 113.563 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.34 65.51 0.25 Allowed Glycine 0 CA--C 1.523 0.587 0 C-N-CA 121.305 -0.474 . . . . 0.54 112.854 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.635 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -109.85 -171.83 1.92 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.38 110.733 -178.213 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 0.86 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.561 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 0.31 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 7' ' ' CYS . 11.2 t30 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.57 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.714 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 0.76 112.687 -174.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 1.9 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 0.33 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 0.42 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.26 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 28' ' ' CYS . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 0.4 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 0.79 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.449 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.03 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HG2' ' NE2' ' A' ' -2' ' ' GLN . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 3.9 110.151 176.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.2 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 0.36 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 1.61 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.22 110.975 -177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.427 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.21 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 0.12 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.567 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 0.21 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.544 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.41 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.782 HD12 ' HB ' ' A' ' -5' ' ' VAL . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 0.54 108.813 174.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.543 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 0.44 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 0.57 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.23 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.19 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.02 114.405 -165.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 1.87 111.351 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 0.59 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.61 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.543 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 -88.3 110.01 32.91 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 3.32 110.83 -173.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.61 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.4 Cg_exo -55.82 117.52 4.16 Favored 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 121.681 1.587 . . . . 0.8 109.466 169.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.714 HD23 ' SG ' ' A' ' 10' ' ' CYS . 6.1 tp -159.49 -69.73 0.08 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.49 -0.777 . . . . 1.8 110.795 -165.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.04 -105.29 0.17 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.601 -0.727 . . . . 3.21 110.966 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.517 ' HG2' ' H ' ' A' ' 47' ' ' LYS . 12.9 ttt -124.74 -173.72 2.86 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.267 -0.642 . . . . 6.47 109.267 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.517 ' H ' ' HG2' ' A' ' 46' ' ' MET . 57.2 mtpt -73.95 67.69 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.085 0.469 . . . . 10.6 110.469 176.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' CD ' ' HA ' ' A' ' 9' ' ' ASN . 30.2 mmtp 57.95 82.38 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.081 -0.963 . . . . 10.22 111.554 -177.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.413 -0.804 . . . . 7.0 109.331 179.271 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.808 0.337 . . . . 17.45 110.288 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -117.34 96.08 5.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.095 0.474 . . . . 15.75 110.044 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -81.82 -29.98 32.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.744 -0.662 . . . . 15.5 110.368 -176.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.4 t-80 -91.56 -51.22 5.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.9 -0.591 . . . . 14.5 110.134 -177.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -79.7 108.58 13.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 12.71 110.529 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -92.58 2.27 56.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.296 0.569 . . . . 11.69 110.444 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -123.13 40.19 3.77 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.492 -0.776 . . . . 9.77 109.698 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -97.28 -72.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 9.59 110.705 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -10' ' ' SER . . . . . 0.61 ' HA ' ' CG ' ' A' ' -6' ' ' GLU . 65.1 m -93.44 3.83 54.95 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.404 0.621 . . . . 7.05 110.963 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 6.9 p -95.96 19.18 11.92 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.595 -0.73 . . . . 6.01 110.58 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -149.38 -109.17 0.49 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.324 -0.941 . . . . 2.88 113.63 -176.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.594 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.8 OUTLIER -82.97 53.51 2.45 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.611 0.967 . . . . 2.25 113.611 -168.409 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' -6' ' ' GLU . . . . . 0.61 ' CG ' ' HA ' ' A' ' -10' ' ' SER . 7.0 mm-40 -90.17 50.78 1.91 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 3.44 111.424 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.485 ' HB ' HD12 ' A' ' 33' ' ' LEU . 14.0 p -139.46 34.59 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.926 0.87 . . . . 1.67 109.154 177.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 37.8 tp -76.17 57.34 1.11 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.577 -0.738 . . . . 3.12 111.116 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' PHE . . . . . 0.501 ' CD2' ' HG2' ' A' ' -2' ' ' GLN . 15.3 p90 -156.79 14.74 0.28 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.711 -0.677 . . . . 2.17 110.548 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.501 ' HG2' ' CD2' ' A' ' -3' ' ' PHE . 82.4 mm-40 -143.7 33.7 1.28 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.257 -0.429 . . . . 2.74 111.349 -175.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLY . . . . . 0.425 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . 134.09 155.41 7.57 Favored Glycine 0 CA--C 1.524 0.622 0 C-N-CA 120.262 -0.971 . . . . 1.43 113.674 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 0' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 6.2 Cg_endo -90.21 -144.25 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.979 3.119 . . . . 2.08 112.632 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.428 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 16.8 ptp180 -121.72 -163.71 1.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.598 -0.274 . . . . 5.35 110.432 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 18.0 ttm180 -158.63 1.42 0.1 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.745 0.307 . . . . 2.94 111.029 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.4 -94.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.618 0.969 . . . . 1.09 113.618 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.11 60.95 0.32 Allowed Glycine 0 CA--C 1.52 0.352 0 C-N-CA 121.167 -0.539 . . . . 0.54 113.17 -170.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.637 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -111.08 -171.8 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.078 0.439 . . . . 0.38 110.164 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.637 ' H ' HG22 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 0.86 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 0.31 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.2 t30 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.57 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.69 ' SG ' HD23 ' A' ' 44' ' ' LEU . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 0.76 112.058 -176.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 1.9 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.421 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 0.33 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 5' ' ' THR . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 0.42 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.26 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.801 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 0.4 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 0.54 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 0.79 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.421 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.806 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.03 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 3.9 110.914 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.2 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 0.36 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 1.61 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.22 112.105 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.618 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.618 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.21 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.597 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 0.12 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.801 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD23 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 0.21 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.41 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.563 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB ' ' A' ' -5' ' ' VAL . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 0.54 108.801 174.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HE1' HG23 ' A' ' 40' ' ' VAL . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 0.44 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 0.57 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.563 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.23 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.19 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG22 ' A' ' 40' ' ' VAL . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.02 114.559 -167.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 1.87 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.656 HG23 ' HE1' ' A' ' 34' ' ' TYR . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 0.59 110.131 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.654 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.638 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -98.92 100.68 10.28 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 3.32 109.445 -174.575 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.654 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.0 Cg_exo -59.54 117.67 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.045 1.83 . . . . 0.8 111.942 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.69 HD23 ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -125.92 -84.79 0.63 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.256 -0.884 . . . . 1.8 109.663 174.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 42.86 37.86 1.21 Allowed 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.901 -1.045 . . . . 3.21 113.436 -178.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 90.1 mmm 63.78 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.356 0.889 0 CA-C-O 121.415 0.626 . . . . 6.47 110.802 -176.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -128.0 -65.17 0.92 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.127 -0.942 . . . . 10.6 109.168 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -166.95 88.17 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.499 -0.773 . . . . 10.22 110.246 174.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-N 116.439 -0.346 . . . . 7.0 110.378 177.986 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -18' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' -15' ' ' HIS . 1.7 mpt? . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 121.079 0.466 . . . . 17.45 110.606 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.62 -28.04 23.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.241 -0.436 . . . . 15.75 111.165 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -82.34 -45.3 15.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.8 0.333 . . . . 15.5 110.345 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -15' ' ' HIS . . . . . 0.467 ' O ' ' HB3' ' A' ' -18' ' ' MET . 45.3 p-80 -128.73 129.23 45.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.722 -0.473 . . . . 14.5 109.722 176.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -102.27 142.82 32.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.159 -0.473 . . . . 12.71 110.56 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -73.87 113.26 10.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 11.69 109.721 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -90.09 90.82 8.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.21 0.529 . . . . 9.77 110.978 -176.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -95.17 114.53 26.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.643 -0.708 . . . . 9.59 109.602 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 90.73 1.07 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.042 0.448 . . . . 7.05 110.174 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.6 t -86.17 62.19 7.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.155 0.502 . . . . 6.01 110.809 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -73.82 -29.11 63.68 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 111.236 -0.746 . . . . 2.88 111.236 175.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.751 ' H ' HD23 ' A' ' -7' ' ' LEU . 1.1 pt? -75.78 60.55 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.9 0.857 . . . . 2.25 110.428 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -86.47 -21.07 27.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.938 -1.028 . . . . 3.44 111.13 -176.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.522 ' HB ' HD12 ' A' ' 33' ' ' LEU . 11.3 p -77.27 120.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.838 -0.619 . . . . 1.67 110.745 -177.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 44.3 tp -117.3 -23.38 7.85 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.015 0.436 . . . . 3.12 110.722 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -83.24 140.55 32.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.99 -0.55 . . . . 2.17 110.93 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.47 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 84.2 mm-40 53.1 72.46 0.42 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.805 -0.634 . . . . 2.74 111.56 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -178.91 124.34 0.91 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.377 -0.916 . . . . 1.43 113.188 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -77.4 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 123.323 2.682 . . . . 2.08 112.063 174.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -155.27 158.21 38.45 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 5.35 110.134 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' HD1' ' A' ' 18' ' ' TRP . 18.7 ttt180 -158.54 175.75 13.27 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.679 -0.86 . . . . 2.94 108.679 -177.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.29 166.32 28.36 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.964 -0.384 . . . . 1.09 109.964 170.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.86 40.16 49.15 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 120.955 -0.64 . . . . 0.54 112.756 -173.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.518 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.2 178.64 4.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.697 -0.296 . . . . 0.38 111.03 -174.186 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.465 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 0.86 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 0.31 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.494 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.57 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 0.76 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 1.9 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 0.33 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 0.42 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.26 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.622 HG21 ' HA ' ' A' ' 28' ' ' CYS . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 0.4 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 0.54 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.612 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 0.79 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.455 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.03 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 3.9 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.2 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 0.36 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 1.61 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.22 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.516 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.21 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 0.12 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' HG21 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.516 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 0.21 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.41 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.757 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 0.54 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 0.44 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 0.57 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.757 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.23 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.19 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.02 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 1.87 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.563 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 0.59 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.503 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.516 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 48.3 ttt180 -84.11 114.16 52.67 Favored Pre-proline 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 3.32 110.38 -172.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.503 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 89.2 Cg_exo -53.84 116.99 3.39 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.731 1.621 . . . . 0.8 110.503 171.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 44' ' ' LEU . 2.6 tp -159.64 -142.78 0.09 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.063 -0.971 . . . . 1.8 108.39 -168.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.4 m 79.66 -50.49 0.39 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.954 0.784 . . . . 3.21 112.284 168.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.427 ' CG ' ' HB2' ' A' ' 49' ' ' GLU . 12.5 tpt -162.64 165.84 25.29 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.254 -1.017 . . . . 6.47 108.254 -178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.3 75.25 1.0 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.811 -0.44 . . . . 10.6 109.811 176.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 59.78 82.73 0.15 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.861 -1.063 . . . . 10.22 111.557 -175.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB2' ' CG ' ' A' ' 46' ' ' MET . 38.3 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.68 -0.676 . . . . 7.0 110.089 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.735 0.303 . . . . 17.45 111.068 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.98 151.99 22.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.817 0.341 . . . . 15.75 111.312 -176.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -136.89 123.13 20.53 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.896 -0.593 . . . . 15.5 109.761 175.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -84.66 67.89 10.18 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.677 0.751 . . . . 14.5 110.722 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -83.05 -35.08 26.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.469 -0.787 . . . . 12.71 110.089 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -135.92 145.04 45.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.913 -0.585 . . . . 11.69 109.929 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -157.38 -23.11 0.09 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.636 0.255 . . . . 9.77 110.425 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 31.5 m-70 72.89 -68.44 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.646 0.778 . . . . 9.59 111.389 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 7.6 m -81.25 116.4 21.11 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.972 -0.381 . . . . 7.05 109.972 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 23.1 t -112.92 -50.33 2.89 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.873 0.368 . . . . 6.01 110.624 -178.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -81.87 77.91 2.01 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 2.88 112.043 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -7' ' ' LEU . . . . . 0.576 HD23 HD21 ' A' ' 29' ' ' ASN . 84.0 mt -92.73 77.08 4.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.796 0.331 . . . . 2.25 110.529 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -158.48 142.93 15.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 3.44 111.094 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -5' ' ' VAL . . . . . 0.567 HG23 ' HG ' ' A' ' 33' ' ' LEU . 5.0 p -126.66 1.76 4.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.243 0.544 . . . . 1.67 109.656 173.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 62.9 mt 77.55 -65.38 0.27 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 114.905 -1.043 . . . . 3.12 111.859 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -88.91 177.95 6.55 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.698 0.259 . . . . 2.17 111.698 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLN . . . . . 0.566 ' HB3' HH12 ' A' ' 19' ' ' ARG . 34.4 tp60 62.91 97.3 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.889 -0.596 . . . . 2.74 110.203 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -58.67 115.92 7.87 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.287 -0.415 . . . . 1.43 113.743 -174.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -94.25 146.01 1.85 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.513 2.809 . . . . 2.08 112.884 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -177.22 128.72 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.363 -0.38 . . . . 5.35 110.691 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' CB ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER 174.74 -32.24 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 O-C-N 123.637 0.586 . . . . 2.94 111.247 174.31 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.34 -83.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.398 0.888 . . . . 1.09 113.398 173.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.49 65.46 0.25 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 121.435 -0.412 . . . . 0.54 112.437 -174.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.717 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.1 m -121.63 -172.49 2.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.432 0.616 . . . . 0.38 110.756 -175.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.717 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 0.86 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 0.31 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.57 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 0.76 111.873 -172.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 1.9 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 0.33 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.63 HG22 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 0.42 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.26 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 0.4 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.4 ' H ' HD13 ' A' ' -7' ' ' LEU . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 0.54 110.489 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 0.79 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.482 ' CB ' ' HB2' ' A' ' 2' ' ' ARG . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.566 HH12 ' HB3' ' A' ' -2' ' ' GLN . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.03 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.533 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 3.9 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.2 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 0.36 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 1.61 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.533 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.22 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.557 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.21 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 0.12 109.529 178.626 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.576 HD21 HD23 ' A' ' -7' ' ' LEU . 3.5 t30 -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 0.21 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' HD11 ' A' ' 44' ' ' LEU . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.41 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.732 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.68 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 0.54 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HE1' HG23 ' A' ' 40' ' ' VAL . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 0.44 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 0.57 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.23 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.19 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.02 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 1.87 112.063 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 0.59 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.547 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.714 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.4 tmt_? -90.63 110.43 41.28 Favored Pre-proline 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 3.32 109.512 -172.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.547 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 83.9 Cg_exo -54.02 120.52 8.06 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.301 2.0 . . . . 0.8 111.432 172.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 10.7 mt -123.65 -140.97 0.31 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.77 -0.65 . . . . 1.8 109.514 -170.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 48' ' ' LYS . 6.5 m 69.61 -86.82 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 123.552 0.533 . . . . 3.21 110.961 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 45.2 tpp 53.62 84.0 0.06 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.419 0.687 . . . . 6.47 110.879 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 47' ' ' LYS . 34.9 tptt 66.64 37.23 4.45 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.575 -0.739 . . . . 10.6 109.666 -177.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.441 ' H ' HG22 ' A' ' 45' ' ' THR . 56.5 tttp 48.93 74.1 0.2 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.339 -1.3 . . . . 10.22 112.737 -177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.465 -0.778 . . . . 7.0 109.992 173.444 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.661 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.009 -0.043 . . . . 0.38 111.019 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.661 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 0.86 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 0.31 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.57 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 0.76 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 1.9 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 0.33 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 0.42 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.498 ' O ' HG23 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.26 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 0.4 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 0.54 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 0.79 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.499 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.03 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 3.9 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.2 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 0.36 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 1.61 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.518 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.22 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.524 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.524 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.21 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 0.12 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.567 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.519 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 0.21 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.41 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.603 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 0.54 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 0.44 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.57 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.23 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.19 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.02 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 1.87 111.953 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 0.59 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 20.0 ttt180 . . . . . 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 3.32 110.693 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.694 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 110.59 -0.152 . . . . 0.38 110.59 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.694 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 0.86 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.49 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.485 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 0.31 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.57 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 0.76 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 1.9 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 0.33 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 0.42 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.26 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.683 HG22 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 0.4 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 0.54 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.734 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 0.79 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.738 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.03 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 3.9 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.2 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 0.36 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 1.61 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.536 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.22 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.21 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 0.12 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.639 ' HA ' HG21 ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.677 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 0.21 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.41 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 0.54 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 0.44 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 0.57 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.23 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.19 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.448 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.02 113.991 -160.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 1.87 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 0.59 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 3.32 110.659 -175.675 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.703 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m . . . . . 0 C--O 1.223 -0.34 0 N-CA-C 110.554 -0.165 . . . . 0.38 110.554 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.611 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 0.86 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 0.31 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.568 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.2 t30 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.57 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 0.76 112.275 -175.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 1.9 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 0.33 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 0.42 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.26 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.559 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 0.4 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 0.54 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.559 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 0.79 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.03 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.529 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 3.9 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.2 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 0.36 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 1.61 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.529 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.22 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.605 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.605 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.21 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.583 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 0.12 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.429 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 0.21 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.583 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.41 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.767 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.798 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 0.54 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 0.44 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.57 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.23 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.798 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.19 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.452 ' O ' HG22 ' A' ' 40' ' ' VAL . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.02 114.084 -165.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 1.87 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 0.59 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.567 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 3.32 109.342 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.036 0.013 . . . . 0.38 111.036 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.673 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 0.86 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.489 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 0.31 113.803 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.57 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 0.76 111.337 -171.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 1.9 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 0.33 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 0.42 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.26 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 0.4 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 0.54 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.699 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 0.79 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.03 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.542 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 3.9 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.2 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.702 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 0.36 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 1.61 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.542 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.22 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.21 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 0.12 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.653 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.511 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 0.21 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.41 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.73 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 0.54 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 0.44 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.702 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 0.57 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.73 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.23 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.19 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.465 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 50.0 m-70 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.02 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 1.87 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 0.59 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 2.7 tmt_? . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 3.32 109.151 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.728 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 111.148 0.055 . . . . 0.38 111.148 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.728 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 0.86 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 0.31 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.491 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.57 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 0.76 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 1.9 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 0.33 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 0.42 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.26 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 0.4 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 0.54 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.705 ' H ' HG22 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 0.79 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.634 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.03 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.519 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 3.9 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.2 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 0.36 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 1.61 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.519 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.22 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.497 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.21 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.41 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 0.12 109.293 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.615 HD21 HD13 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 0.21 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.41 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.41 111.661 -175.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 0.54 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.723 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 0.44 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 0.57 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.23 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.19 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.44 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.02 114.601 -161.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 1.87 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 38' ' ' HIS . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 0.59 109.914 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.723 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 3.32 110.414 -174.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.715 ' O ' HG22 ' A' ' 13' ' ' THR . 0.7 OUTLIER . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 109.926 -0.398 . . . . 0.38 109.926 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.597 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 0.86 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.586 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 0.31 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.586 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.0 t30 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.57 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 0.76 112.513 -175.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 1.9 113.529 -172.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.432 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 0.33 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.715 HG22 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 0.42 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.26 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.65 HG21 ' HA ' ' A' ' 28' ' ' CYS . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 0.4 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 0.54 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.624 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 0.79 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HH2' ' O ' ' A' ' 12' ' ' THR . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.624 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.03 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 3.9 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.2 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 0.36 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 1.61 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.22 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.499 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.21 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 0.12 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.65 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.405 ' ND2' ' HB2' ' A' ' 33' ' ' LEU . 1.5 t-20 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 0.21 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.41 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.817 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 0.54 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.606 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 0.44 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 0.57 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.562 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.23 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.817 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.19 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 64.4 m-70 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.02 114.436 -166.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 1.87 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.434 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 0.59 109.768 175.58 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.606 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 3.32 109.062 -174.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 110.35 -0.241 . . . . 0.38 110.35 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.662 ' H ' HG22 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 0.86 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 0.31 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.4 t30 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.57 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.401 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 0.76 112.131 -175.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 1.9 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 0.33 109.271 173.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 0.42 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 0.4 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 0.54 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.676 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 0.79 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.03 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 3.9 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.2 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 0.36 113.349 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 1.61 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.22 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.467 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.21 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.563 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 0.12 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 0.21 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.716 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.41 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.721 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 0.54 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HE1' HG23 ' A' ' 40' ' ' VAL . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 0.44 111.414 -173.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 0.57 110.558 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.721 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.23 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.19 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.02 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 1.87 111.972 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.593 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 0.59 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.716 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 . . . . . 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 3.32 110.433 -174.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.7 m . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 110.586 -0.153 . . . . 0.38 110.586 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 0.86 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 0.31 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.57 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 0.76 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 1.9 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 0.33 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 0.42 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.26 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 0.4 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.54 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' THR . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 0.79 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.03 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.64 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 3.9 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.2 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 0.36 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 1.61 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.22 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.21 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB2' HG21 ' A' ' 15' ' ' THR . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.522 HD21 HD13 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 0.21 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.41 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.714 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 0.54 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 0.44 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 0.57 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.23 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.19 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.02 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 1.87 112.202 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.59 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 3.32 110.772 -167.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.516 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 119.986 -0.054 . . . . 0.38 111.116 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 0.86 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.485 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 0.31 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.57 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 0.76 112.308 -173.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 1.9 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 0.33 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 0.42 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.26 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.635 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 0.4 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 0.54 111.584 -178.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 0.79 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.03 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 3.9 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.2 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 0.36 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 1.61 108.196 -173.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.22 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.21 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 0.12 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.526 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.454 ' H ' HG21 ' A' ' 15' ' ' THR . 0.9 OUTLIER -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 0.21 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.41 111.614 -173.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.595 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD13 HD21 ' A' ' 29' ' ' ASN . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 0.54 109.585 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 0.44 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 0.57 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.23 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.19 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.02 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 1.87 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.411 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 0.59 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 3.32 110.154 -176.212 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.635 -0.135 . . . . 0.38 110.635 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 0.86 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.427 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 0.31 113.4 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.52 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.57 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 0.76 111.775 -172.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 1.9 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 0.33 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 0.42 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.476 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.26 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.618 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 0.4 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 0.54 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.618 ' H ' HG22 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 0.79 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.03 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 3.9 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.2 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 0.36 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 1.61 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.22 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.52 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.21 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 0.12 109.09 177.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.465 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 0.21 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.41 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.74 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 0.54 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.425 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 0.44 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 0.57 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.23 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.19 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.02 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 1.87 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 0.59 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 2.0 tmt_? . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 3.32 109.192 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 CA--C 1.534 0.349 0 N-CA-C 110.634 -0.136 . . . . 0.38 110.634 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.693 ' H ' HG22 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 0.86 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 0.31 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.574 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.8 t30 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.57 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 0.76 111.953 -175.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 1.9 113.772 -171.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 0.33 108.911 171.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 0.42 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.26 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 0.4 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 0.54 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.629 ' H ' HG22 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 0.79 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.509 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.03 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.7 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 3.9 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' ASP . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.2 109.042 171.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 0.36 113.99 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 1.61 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.22 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.7 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.21 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.12 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.555 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.582 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 0.21 113.416 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.41 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.729 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.689 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 0.54 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 0.44 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.57 111.383 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.23 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.19 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.02 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m120 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 1.87 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 0.59 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 58.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 3.32 110.872 -173.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 119.959 -0.067 . . . . 0.38 111.09 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.702 ' H ' HG22 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 0.86 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.575 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 0.31 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.575 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.6 t30 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.57 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 0.76 112.188 -175.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 1.9 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 0.33 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 0.42 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.26 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.623 HG21 ' HA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.4 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 0.54 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.654 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 0.79 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.03 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.704 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 3.9 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.422 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.2 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 0.36 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 1.61 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.532 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.22 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.704 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.21 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 0.12 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.617 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 0.21 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.41 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.585 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.717 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 0.54 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.511 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 0.44 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.495 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 0.57 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.23 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.19 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.02 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 1.87 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 0.59 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 3.32 109.777 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.689 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 109.456 -0.572 . . . . 0.38 109.456 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.66 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 0.86 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 0.31 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.57 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 0.76 112.189 -175.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 1.9 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 0.33 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.689 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 0.42 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.503 ' O ' HG23 ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.26 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.66 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 0.4 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 0.54 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.66 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 0.79 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.03 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.561 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 3.9 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.2 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 0.36 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 1.61 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.22 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.21 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 0.12 109.52 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.485 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.615 ' HB2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 0.21 113.038 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.41 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.756 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 0.54 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 0.44 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 0.57 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.756 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.23 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.19 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.479 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.02 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 1.87 112.093 176.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 0.59 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 49.8 ttt180 . . . . . 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 3.32 110.738 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.784 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.0 m . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 110.021 -0.363 . . . . 0.38 110.021 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.784 ' H ' HG22 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 0.86 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.443 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 0.31 112.979 173.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.3 t30 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.57 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 0.76 111.948 -175.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 1.9 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 0.33 108.655 170.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 0.42 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.26 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.642 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 0.4 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 0.54 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.606 ' H ' HG22 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 0.79 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.03 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 3.9 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.2 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 0.36 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 1.61 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.22 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.585 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.21 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.535 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 0.12 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.642 ' HA ' HG21 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 0.21 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.41 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.646 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 0.54 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.596 ' HE1' HG23 ' A' ' 40' ' ' VAL . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 0.44 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 0.57 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.761 ' HE2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.23 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.19 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.02 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 1.87 111.91 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.596 HG23 ' HE1' ' A' ' 34' ' ' TYR . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 0.59 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 3.32 110.117 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.546 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 110.637 -0.134 . . . . 0.38 110.637 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.546 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 0.86 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 0.31 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.504 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.57 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 0.76 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 1.9 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 0.33 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 0.42 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.26 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.629 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 0.4 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 0.54 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.735 HD23 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 0.79 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.03 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 3.9 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.2 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 0.36 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 1.61 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.22 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.651 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.651 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.21 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 0.12 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.735 ' OD1' HD23 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 0.21 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.41 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 0.54 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.561 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 0.44 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 0.57 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.23 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.19 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.467 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.02 114.077 -162.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 1.87 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.51 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 0.59 110.098 175.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.574 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.5 tmt_? . . . . . 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 3.32 109.37 -169.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.529 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 119.923 -0.084 . . . . 0.38 111.15 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 0.86 109.609 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 0.31 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 6.5 t30 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.57 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 0.76 111.788 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 1.9 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 0.33 107.988 168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 0.42 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.26 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 0.4 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 0.54 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.55 ' H ' HG22 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 0.79 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.467 ' NH1' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.03 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 3.9 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.2 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 0.36 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 1.61 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.22 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.21 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.638 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 0.12 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HA ' HG21 ' A' ' 15' ' ' THR . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 0.21 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.641 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.41 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.793 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.664 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 0.54 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.629 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 0.44 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 0.57 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.793 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.23 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.19 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.02 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 m120 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 1.87 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 0.59 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.641 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.4 tmt_? . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 3.32 110.543 -168.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.635 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.859 -0.115 . . . . 0.38 110.733 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 0.86 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.561 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 0.31 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 7' ' ' CYS . 11.2 t30 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.57 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.435 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 0.76 112.687 -174.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 1.9 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 0.33 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 0.42 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.26 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 28' ' ' CYS . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 0.4 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 0.79 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.03 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 3.9 110.151 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.2 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 0.36 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 1.61 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.22 110.975 -177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.427 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.21 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 0.12 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.567 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 0.21 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.544 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.41 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 0.54 108.813 174.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.543 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 0.44 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 0.57 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.23 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.19 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.02 114.405 -165.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 1.87 111.351 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 0.59 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.543 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 3.32 110.83 -173.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.637 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 110.164 -0.31 . . . . 0.38 110.164 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.637 ' H ' HG22 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 0.86 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 0.31 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.2 t30 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.57 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.416 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 0.76 112.058 -176.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 1.9 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.421 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 0.33 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 5' ' ' THR . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 0.42 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.26 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.801 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 0.4 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 0.54 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 0.79 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.421 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.806 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.03 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 3.9 110.914 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.2 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 0.36 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 1.61 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.22 112.105 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.618 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.618 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.21 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.597 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 0.12 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.801 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD23 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 0.21 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.41 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.563 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 0.54 108.801 174.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HE1' HG23 ' A' ' 40' ' ' VAL . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 0.44 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 0.57 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.563 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.23 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.19 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG22 ' A' ' 40' ' ' VAL . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.02 114.559 -167.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 1.87 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.656 HG23 ' HE1' ' A' ' 34' ' ' TYR . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 0.59 110.131 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.638 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 3.32 109.445 -174.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.518 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.271 0.081 . . . . 0.38 111.03 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.465 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 0.86 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 0.31 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.494 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.57 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 0.76 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 1.9 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 0.33 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 0.42 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.26 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.622 HG21 ' HA ' ' A' ' 28' ' ' CYS . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 0.4 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 0.54 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.612 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 0.79 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.03 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 3.9 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.2 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 0.36 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 1.61 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.22 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.516 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.21 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 0.12 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' HG21 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.516 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 0.21 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.41 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.757 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 0.54 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 0.44 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 0.57 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.757 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.23 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.19 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.02 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 1.87 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.563 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 0.59 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.516 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 48.3 ttt180 . . . . . 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 3.32 110.38 -172.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.717 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.1 m . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 110.756 -0.091 . . . . 0.38 110.756 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.717 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 0.86 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 0.31 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.57 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 0.76 111.873 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 1.9 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 0.33 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.63 HG22 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 0.42 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.26 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 0.4 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 0.54 110.489 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 0.79 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.402 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.561 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.03 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.533 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 3.9 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.2 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 0.36 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 1.61 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.533 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.22 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.557 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.21 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 0.12 109.529 178.626 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 0.21 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.41 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.732 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.68 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 0.54 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HE1' HG23 ' A' ' 40' ' ' VAL . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 0.44 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 0.57 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.23 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.19 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.02 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 1.87 112.063 176.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 0.59 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.493 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 2.4 tmt_? . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 3.32 109.512 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.123 -0.325 . . . . 17.45 110.123 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -157.36 47.02 0.4 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.245 0.545 . . . . 15.75 110.363 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -71.37 133.95 46.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 15.5 110.387 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -154.74 156.99 37.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.021 -0.536 . . . . 14.5 110.04 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -86.88 73.96 9.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.785 0.326 . . . . 12.71 111.369 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -91.48 101.98 14.65 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.465 -0.568 . . . . 11.69 109.465 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -75.4 83.73 2.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.511 0.672 . . . . 9.77 110.757 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -70.56 -21.24 62.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 9.59 110.251 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 47.5 p -94.43 75.75 3.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.289 -0.414 . . . . 7.05 109.993 176.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.5 p -60.26 116.88 4.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.046 -0.525 . . . . 6.01 110.708 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 111.54 -21.5 21.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.82 -0.705 . . . . 2.88 111.791 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.461 HD22 ' N ' ' A' ' -7' ' ' LEU . 1.4 mm? -117.9 87.78 2.78 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.647 -0.871 . . . . 2.25 108.647 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -141.02 73.84 1.44 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.757 0.651 . . . . 3.44 112.757 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.825 ' HB ' HD12 ' A' ' 33' ' ' LEU . 1.5 p -129.18 118.44 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.077 -0.712 . . . . 1.67 109.077 170.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.31 38.92 3.07 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.069 0.462 . . . . 3.12 111.166 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.542 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.1 m-85 -110.3 169.41 8.76 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.151 -0.685 . . . . 2.17 109.151 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 20.2 tm0? 67.98 -82.19 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.058 0.762 . . . . 2.74 113.058 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -154.43 -170.83 20.7 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.685 -0.769 . . . . 1.43 112.885 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -93.73 -96.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.257 2.638 . . . . 2.08 114.537 -175.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -154.89 -171.64 3.91 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 111.958 0.355 . . . . 5.35 111.958 -171.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.427 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 50.7 ttt180 -151.29 9.35 0.56 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.303 -0.408 . . . . 2.94 110.815 -177.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 68.02 -99.15 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.82 1.045 . . . . 1.09 113.82 174.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.96 69.08 0.28 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 121.362 -0.447 . . . . 0.54 112.713 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.661 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -120.13 -172.73 2.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.761 0.781 . . . . 0.38 111.019 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.661 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -124.52 151.22 44.93 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 122.715 0.406 . . . . 0.86 110.86 173.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.6 t -80.87 125.57 30.27 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.275 -0.42 . . . . 0.21 111.288 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.47 24.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.763 1.225 . . . . 0.31 113.448 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 7' ' ' CYS . 42.2 t30 -154.96 -51.17 0.09 Allowed 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 116.413 -0.358 . . . . 0.57 111.272 -176.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.7 p -119.72 8.68 11.23 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.593 -0.843 . . . . 0.76 111.758 -171.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 47.01 13.0 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.893 1.442 . . . . 1.9 114.893 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 t -61.75 146.39 49.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.222 -0.924 . . . . 0.33 108.905 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 5' ' ' THR . 18.8 p -122.87 -0.58 9.01 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.417 -0.81 . . . . 0.42 110.018 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.498 ' O ' HG23 ' A' ' 14' ' ' THR . 14.3 t -92.87 70.51 4.7 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.644 1.211 . . . . 1.26 108.872 176.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 20.7 m -144.34 132.02 21.19 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.0 -1.0 . . . . 0.4 111.099 -176.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.2 m -99.86 -4.84 29.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.4 0.619 . . . . 0.54 111.046 -178.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 14.4 tp -129.62 82.09 2.05 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.237 -0.438 . . . . 0.79 110.826 -176.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.427 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 93.9 m95 -84.55 98.39 10.11 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.447 0.642 . . . . 0.18 111.978 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.499 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -88.37 172.21 9.57 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.082 -0.963 . . . . 2.03 109.84 177.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.5 mmt-85 -104.27 151.32 23.54 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.111 0.481 . . . . 3.9 111.797 177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.1 p30 -97.8 -168.57 1.69 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.481 -0.781 . . . . 0.2 109.168 169.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.75 -21.73 30.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.623 0.971 . . . . 0.36 113.623 -174.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -97.39 -3.54 40.06 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.132 0.968 . . . . 1.61 108.398 -174.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.518 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.57 26.9 58.21 Favored Glycine 0 N--CA 1.428 -1.9 0 N-CA-C 109.724 -1.351 . . . . 0.22 109.724 -169.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.524 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.35 140.04 25.49 Favored Pre-proline 0 CA--C 1.514 -0.434 0 N-CA-C 109.41 -0.589 . . . . 1.27 109.41 -176.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.524 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 15.0 Cg_endo -61.99 130.37 30.65 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 123.915 3.077 . . . . 0.21 112.957 -176.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.76 150.65 25.37 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 N-CA-C 108.693 -0.854 . . . . 0.12 108.693 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.0 p -73.46 172.08 11.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.269 -1.011 . . . . 0.22 108.269 -177.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.567 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -45.32 -54.14 7.54 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 118.728 0.695 . . . . 1.52 111.905 -177.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.519 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -61.78 -49.81 74.86 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.431 0.9 . . . . 0.21 113.431 -174.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.1 m -71.2 -27.16 63.31 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.531 -0.468 . . . . 0.41 111.164 -174.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.603 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -82.3 -37.56 14.64 Favored Glycine 0 C--O 1.223 -0.537 0 C-N-CA 120.319 -0.943 . . . . 0.46 112.499 171.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.825 HD12 ' HB ' ' A' ' -5' ' ' VAL . 9.9 tt -62.07 -45.41 93.63 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.279 -1.008 . . . . 0.54 108.279 177.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -69.99 -50.13 44.72 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.377 -0.828 . . . . 0.44 111.91 -171.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -56.26 -27.02 53.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.57 110.972 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptt -74.06 -30.21 62.27 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.517 0.675 . . . . 1.23 110.1 -177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.7 mt -80.81 -42.45 21.66 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.533 -1.212 . . . . 1.19 110.395 177.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.6 m170 -121.75 -0.73 9.58 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.571 1.323 . . . . 1.02 114.571 -162.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.29 25.6 13.54 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.868 0.366 . . . . 1.87 111.953 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 38' ' ' HIS . 1.0 OUTLIER -151.65 162.69 2.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.287 -0.415 . . . . 0.59 110.39 -177.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.554 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 23.4 m-80 -69.32 164.51 22.7 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.653 -0.499 . . . . 1.73 109.653 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 20.0 ttt180 -94.13 108.7 37.53 Favored Pre-proline 0 C--N 1.317 -0.818 0 C-N-CA 120.747 -0.381 . . . . 3.32 110.693 -173.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.554 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 80.8 Cg_exo -53.89 118.48 5.0 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.137 1.891 . . . . 0.8 110.267 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 44' ' ' LEU . 3.4 tp -154.92 -72.95 0.12 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.565 -0.743 . . . . 1.8 110.74 -167.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.512 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.56 -156.74 0.77 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.547 -0.751 . . . . 3.21 109.466 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 46.9 ttm -80.76 -92.8 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.182 -0.607 . . . . 6.47 109.532 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -140.93 -31.39 0.6 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.795 -0.817 . . . . 10.6 108.795 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 tptt -126.27 71.64 1.28 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.518 -0.764 . . . . 10.22 108.941 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.512 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 42.7 mt-10 . . . . . 0 C--O 1.253 1.24 0 CA-C-N 115.449 -0.796 . . . . 7.0 110.829 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . 0.419 ' O ' ' HB2' ' A' ' -14' ' ' HIS . 25.6 mmt . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.922 0.391 . . . . 17.45 110.575 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -29.75 34.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.165 0.507 . . . . 15.75 110.597 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -89.05 134.1 34.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.803 -0.635 . . . . 15.5 110.059 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 55.9 t60 58.07 47.74 14.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.587 0.708 . . . . 14.5 109.819 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' -18' ' ' MET . 49.7 t-80 -96.79 -44.39 7.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.563 -0.744 . . . . 12.71 110.624 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -151.55 -64.48 0.18 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.094 -0.503 . . . . 11.69 109.682 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -176.02 75.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.724 -0.671 . . . . 9.77 110.011 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -89.49 -36.31 15.47 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.498 -0.556 . . . . 9.59 109.498 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 22.5 t -80.77 137.82 36.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.909 -0.587 . . . . 7.05 109.603 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 5.1 p -86.94 40.99 0.94 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.081 0.467 . . . . 6.01 111.17 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 89.99 -158.76 27.24 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.998 -0.62 . . . . 2.88 111.847 -178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.571 ' O ' ' HG ' ' A' ' -7' ' ' LEU . 2.5 pt? -150.8 93.4 1.94 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.588 0.708 . . . . 2.25 110.638 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -155.62 105.24 2.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.806 -0.634 . . . . 3.44 110.465 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.602 ' HB ' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -153.75 96.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.466 0.65 . . . . 1.67 110.519 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . 0.687 ' H ' HD23 ' A' ' -4' ' ' LEU . 2.5 pt? -88.99 11.21 18.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.99 -0.55 . . . . 3.12 111.1 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.509 ' CD2' HG23 ' A' ' -5' ' ' VAL . 2.6 m-85 -85.63 26.98 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.095 0.474 . . . . 2.17 110.334 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.404 ' HG2' ' HB3' ' A' ' 19' ' ' ARG . 6.0 tp-100 -165.2 -72.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.012 -0.54 . . . . 2.74 109.67 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 125.73 -78.44 0.37 Allowed Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.061 -1.066 . . . . 1.43 114.655 172.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -59.33 174.64 0.96 Allowed 'Trans proline' 0 N--CA 1.479 0.637 0 C-N-CA 123.955 3.104 . . . . 2.08 116.016 -166.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -146.18 -179.49 6.77 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.759 -1.564 . . . . 5.35 108.531 176.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.419 ' N ' ' HB2' ' A' ' 18' ' ' TRP . 56.4 ttt180 -156.64 22.05 0.34 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.044 -0.663 . . . . 2.94 112.077 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.26 -89.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.244 1.202 . . . . 1.09 114.244 173.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.57 60.72 0.52 Allowed Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.089 -0.577 . . . . 0.54 112.825 -170.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.694 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -104.09 -169.14 1.59 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 117.045 0.423 . . . . 0.38 110.59 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.694 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.35 149.94 40.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.919 0.39 . . . . 0.86 111.636 173.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.49 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.3 t -83.74 124.22 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.948 -0.569 . . . . 0.21 111.554 -173.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.485 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -62.61 23.83 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.547 1.139 . . . . 0.31 113.839 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.1 t30 -157.11 -45.64 0.07 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 111.777 0.288 . . . . 0.57 111.777 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.8 p -124.04 10.4 8.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 119.154 -1.018 . . . . 0.76 111.899 -175.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 39.79 21.63 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.891 1.811 . . . . 1.9 115.891 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.3 t -65.74 149.39 50.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.689 -0.856 . . . . 0.33 108.689 166.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 5' ' ' THR . 17.0 p -124.13 3.41 8.6 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.066 0.936 . . . . 0.42 109.413 177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.75 76.69 2.49 Favored 'General case' 0 N--CA 1.432 -1.363 0 CA-C-N 114.205 -1.362 . . . . 1.26 109.548 175.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.683 HG22 ' H ' ' A' ' 17' ' ' LEU . 57.7 m -150.63 136.49 18.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.948 -0.569 . . . . 0.4 110.862 -176.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -97.37 -10.16 26.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.316 -0.402 . . . . 0.54 111.458 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.734 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 7.2 tp -126.85 89.02 2.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 120.076 -0.65 . . . . 0.79 111.195 -175.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.419 ' HB2' ' N ' ' A' ' 2' ' ' ARG . 92.8 m95 -90.35 97.31 11.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.319 0.58 . . . . 0.18 112.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.738 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.71 172.26 9.38 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.384 -0.826 . . . . 2.03 109.856 175.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.0 mmt-85 -102.06 148.16 25.72 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.699 0.285 . . . . 3.9 111.103 174.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -92.42 -170.25 2.44 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.725 -0.842 . . . . 0.2 108.725 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.93 -30.38 46.27 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.771 1.026 . . . . 0.36 113.771 -169.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -105.18 4.57 31.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.815 0.817 . . . . 1.61 108.978 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.536 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.97 27.77 20.28 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.03 -0.987 . . . . 0.22 112.227 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.629 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -92.55 142.17 25.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 C-N-CA 120.33 -0.548 . . . . 1.27 109.974 -179.245 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.629 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.2 Cg_endo -62.49 130.34 29.67 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 123.814 3.01 . . . . 0.21 112.684 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 145.77 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 109.207 -0.664 . . . . 0.12 109.207 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.639 ' HA ' HG21 ' A' ' 15' ' ' THR . 2.5 p -69.04 166.4 18.16 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.337 -0.986 . . . . 0.22 108.337 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.677 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -50.73 -55.76 15.12 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 119.107 0.867 . . . . 1.52 112.247 -170.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.19 -47.28 72.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 118.945 0.793 . . . . 0.21 112.84 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.51 -36.4 80.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.648 0.24 . . . . 0.41 111.648 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.575 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.6 -35.38 41.28 Favored Glycine 0 C--O 1.221 -0.69 0 C-N-CA 119.914 -1.136 . . . . 0.46 112.262 173.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -67.63 -45.39 75.49 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 109.175 -0.676 . . . . 0.54 109.175 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -70.8 -39.74 72.94 Favored 'General case' 0 N--CA 1.427 -1.615 0 C-N-CA 120.418 -0.513 . . . . 0.44 110.867 -173.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 85.6 t80 -61.24 -28.14 68.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.82 -0.627 . . . . 0.57 110.665 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -76.76 -28.55 55.76 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.501 0.667 . . . . 1.23 110.24 -176.195 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.0 mt -83.17 -43.33 16.28 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 1.19 110.078 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.448 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.6 m170 -121.19 4.07 10.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.991 1.108 . . . . 1.02 113.991 -160.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 63.31 17.59 10.37 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 112.566 0.58 . . . . 1.87 112.566 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.37 161.59 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 C-N-CA 120.61 -0.436 . . . . 0.59 110.558 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.535 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 16.1 m-80 -66.94 161.66 23.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.062 -0.517 . . . . 1.73 110.109 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -82.27 115.66 59.07 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.332 -0.394 . . . . 3.32 110.659 -175.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.6 Cg_exo -57.06 117.61 4.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.474 1.449 . . . . 0.8 108.948 165.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.9 tp -150.94 -73.46 0.16 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.633 -0.712 . . . . 1.8 110.865 -166.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 19.0 p -139.47 -159.49 0.96 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.175 -0.466 . . . . 3.21 110.209 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.449 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 5.7 tpt -98.74 -154.07 0.45 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.203 -1.036 . . . . 6.47 108.203 176.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 46' ' ' MET . 88.7 mttt -83.94 -30.39 26.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.38 0.61 . . . . 10.6 109.548 174.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -126.76 84.17 2.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 10.22 109.59 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 45' ' ' THR . 52.1 mm-40 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.173 -0.917 . . . . 7.0 111.234 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.977 0.418 . . . . 17.45 110.587 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -126.07 49.85 1.93 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.148 -0.478 . . . . 15.75 111.074 -177.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -58.98 109.44 0.83 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.513 . . . . 15.5 111.072 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.1 m80 57.54 25.45 11.56 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.742 -0.663 . . . . 14.5 111.316 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -103.45 21.04 16.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.647 0.737 . . . . 12.71 109.444 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' -11' ' ' HIS . 2.5 p-80 -165.32 162.38 19.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.154 -0.93 . . . . 11.69 109.707 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -110.26 80.76 1.34 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.208 -0.664 . . . . 9.77 109.208 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . 0.41 ' HB2' ' CD2' ' A' ' -13' ' ' HIS . 20.2 t-80 -93.04 70.46 4.55 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.408 -0.815 . . . . 9.59 110.707 -172.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.9 m -64.83 -51.43 62.15 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.928 -0.767 . . . . 7.05 108.928 173.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 15.5 t -159.88 118.74 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.342 -0.844 . . . . 6.01 109.048 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -158.92 152.64 23.73 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.434 -0.666 . . . . 2.88 111.434 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.639 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -91.51 102.35 15.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.732 0.777 . . . . 2.25 112.103 -174.229 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -133.52 9.93 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.564 -0.744 . . . . 3.44 111.223 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.554 HG12 HD21 ' A' ' 29' ' ' ASN . 11.4 p -116.34 130.16 71.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.106 -0.331 . . . . 1.67 110.106 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 95.7 mt -131.53 33.66 4.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.983 0.421 . . . . 3.12 110.928 -178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -139.5 132.04 28.73 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.309 -0.405 . . . . 2.17 110.705 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 58.61 67.91 0.88 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.507 -0.769 . . . . 2.74 111.365 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.432 ' HA3' ' HB3' ' A' ' 19' ' ' ARG . . . 167.78 116.48 0.36 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.696 -0.764 . . . . 1.43 113.024 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -89.88 -146.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.118 2.545 . . . . 2.08 112.514 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 91.9 mtm180 -122.74 -163.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.68 -0.489 . . . . 5.35 109.68 177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.532 ' HD2' ' OG1' ' A' ' 5' ' ' THR . 0.0 OUTLIER 179.44 -15.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.68 0.276 . . . . 2.94 110.558 -178.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.38 -94.08 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.618 0.97 . . . . 1.09 113.618 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.39 59.44 3.02 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.388 -0.434 . . . . 0.54 112.719 -172.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.703 ' O ' HG22 ' A' ' 13' ' ' THR . 1.3 m -121.04 -176.84 3.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.368 0.584 . . . . 0.38 110.554 -176.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.611 ' H ' HG22 ' A' ' 5' ' ' THR . 3.4 p -125.6 148.27 49.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.514 0.326 . . . . 0.86 111.012 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -77.0 128.2 34.07 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 120.215 -0.594 . . . . 0.21 111.103 -173.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.88 24.94 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.519 1.128 . . . . 0.31 112.786 174.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.568 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.2 t30 -160.18 -43.45 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.949 -0.569 . . . . 0.57 111.022 -174.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.612 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.8 m -111.72 -4.74 14.58 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 120.401 -0.52 . . . . 0.76 112.275 -175.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 44.17 17.84 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.313 1.227 . . . . 1.9 114.313 -175.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.0 t -72.98 159.15 34.12 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.988 -0.745 . . . . 0.33 108.988 171.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 5' ' ' THR . 30.1 p -127.76 -0.84 6.05 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.095 0.95 . . . . 0.42 109.592 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.15 75.63 3.45 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.249 -1.341 . . . . 1.26 109.976 176.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.559 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.7 m -150.95 138.23 19.37 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.942 -0.572 . . . . 0.4 110.186 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -90.42 -14.24 33.29 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.837 0.31 . . . . 0.54 111.837 -173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.559 ' H ' HG22 ' A' ' 15' ' ' THR . 8.9 tp -130.14 110.13 11.35 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.329 -0.548 . . . . 0.79 110.34 -176.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 91.0 m95 -103.72 92.8 4.59 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.391 0.615 . . . . 0.18 110.799 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.432 ' HB3' ' HA3' ' A' ' -1' ' ' GLY . 0.0 OUTLIER -86.42 173.09 9.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.252 -0.886 . . . . 2.03 109.543 175.512 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.529 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 4.7 mmt-85 -101.02 149.22 24.16 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.771 0.319 . . . . 3.9 111.546 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -94.0 -168.24 1.84 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.667 -0.697 . . . . 0.2 109.319 172.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.17 -32.8 24.6 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 113.796 1.036 . . . . 0.36 113.796 -170.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -109.52 10.16 25.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.539 0.685 . . . . 1.61 109.448 -172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.529 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.0 26.91 27.6 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.175 -0.921 . . . . 0.22 112.454 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.605 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.57 142.09 25.41 Favored Pre-proline 0 C--N 1.326 -0.435 0 C-N-CA 120.341 -0.544 . . . . 1.27 110.071 -177.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.605 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 17.2 Cg_endo -62.98 130.97 30.86 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 123.954 3.103 . . . . 0.21 112.721 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.583 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.79 150.24 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 CA-C-O 121.074 0.464 . . . . 0.12 110.136 -178.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.429 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.9 p -69.16 162.37 27.18 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.501 -1.296 . . . . 0.22 107.501 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -53.83 -49.82 67.56 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.42 1.009 . . . . 1.52 111.71 -170.146 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.97 -44.71 30.62 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 118.38 0.536 . . . . 0.21 112.214 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.583 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 85.4 m -70.58 -46.29 63.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.515 0.561 . . . . 0.41 112.515 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.767 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.09 -24.96 74.74 Favored Glycine 0 C--O 1.218 -0.895 0 C-N-CA 119.298 -1.429 . . . . 0.46 111.603 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.798 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.4 tt -73.71 -46.15 47.91 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.914 -1.143 . . . . 0.54 107.914 173.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CD2' ' HG2' ' A' ' 42' ' ' ARG . 55.2 t80 -67.71 -52.68 34.85 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.717 -0.674 . . . . 0.44 111.231 -172.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 90.4 t80 -57.04 -26.52 60.46 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.57 111.692 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.5 mptp? -77.79 -34.03 52.34 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.585 0.707 . . . . 1.23 110.678 -176.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.798 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mt -82.59 -35.49 27.04 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.652 -1.158 . . . . 1.19 110.389 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.452 ' O ' HG22 ' A' ' 40' ' ' VAL . 68.2 m-70 -119.58 -1.93 10.56 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.084 1.142 . . . . 1.02 114.084 -165.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 64.73 17.06 10.77 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 112.133 0.42 . . . . 1.87 112.133 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER -144.21 157.57 15.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 C-N-CA 120.709 -0.396 . . . . 0.59 109.977 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.637 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 25.7 m-80 -71.53 163.09 28.38 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.803 -0.443 . . . . 1.73 109.803 -177.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.567 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -89.95 105.62 11.76 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.342 -0.614 . . . . 3.32 109.342 -174.286 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.637 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.1 Cg_exo -52.3 118.1 4.28 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 121.854 1.703 . . . . 0.8 110.121 176.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.612 HD23 ' SG ' ' A' ' 10' ' ' CYS . 3.9 tp -166.26 -71.5 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.284 -0.871 . . . . 1.8 109.706 -166.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER 50.76 -97.64 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.689 -1.141 . . . . 3.21 112.343 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.433 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 21.9 mmt -121.65 44.94 2.43 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.015 -0.539 . . . . 6.47 109.769 -177.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 70.81 -68.72 0.2 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.102 -0.953 . . . . 10.6 111.479 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -144.69 80.4 1.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.817 0.342 . . . . 10.22 111.307 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' HG2' ' HB2' ' A' ' 46' ' ' MET . 36.1 mm-40 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.645 -0.693 . . . . 7.0 109.984 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.096 0.474 . . . . 17.45 110.213 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -77.86 -11.06 59.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.153 -0.476 . . . . 15.75 111.849 -175.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -104.85 13.98 30.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.144 0.497 . . . . 15.5 110.84 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -139.6 115.96 10.56 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.319 -0.623 . . . . 14.5 109.319 175.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -118.05 8.3 12.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.753 0.311 . . . . 12.71 111.51 -174.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -142.9 109.41 5.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.392 0.615 . . . . 11.69 110.286 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -79.76 -77.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.403 -0.817 . . . . 9.77 110.751 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 67.0 150.66 0.06 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.614 0.721 . . . . 9.59 111.605 -177.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 17.3 m -86.03 51.74 2.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 7.05 110.806 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 37.9 m -138.6 33.01 2.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.75 -0.659 . . . . 6.01 109.894 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -92.52 -130.97 5.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.477 -0.783 . . . . 2.88 111.157 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.639 HD13 ' H ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -80.21 43.31 0.62 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.575 0.702 . . . . 2.25 110.872 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -88.9 -13.15 39.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.133 -0.94 . . . . 3.44 111.239 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.603 ' HB ' HD12 ' A' ' 33' ' ' LEU . 5.4 p -72.13 100.45 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.622 0.725 . . . . 1.67 110.457 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 24.2 tp -142.27 73.2 1.4 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.439 0.638 . . . . 3.12 110.223 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.54 -33.65 0.3 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.328 -0.851 . . . . 2.17 110.554 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.414 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 13.0 mm-40 -140.97 83.25 1.88 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 2.74 110.681 178.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 151.61 131.35 1.75 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 120.698 -0.763 . . . . 1.43 113.047 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -92.2 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 123.491 2.794 . . . . 2.08 112.86 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -130.95 -163.3 1.3 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.692 -0.484 . . . . 5.35 109.692 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -176.33 14.45 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.73 0.3 . . . . 2.94 111.717 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.89 -95.74 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.316 1.228 . . . . 1.09 114.316 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.12 57.23 0.6 Allowed Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.943 -0.646 . . . . 0.54 112.91 -170.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -97.07 -168.65 1.73 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.74 -0.271 . . . . 0.38 111.036 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.673 ' H ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -118.69 151.51 37.85 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.77 0.319 . . . . 0.86 111.322 172.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -83.69 124.51 30.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.173 -0.467 . . . . 0.21 111.831 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.489 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -61.32 24.11 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.961 1.304 . . . . 0.31 113.803 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 28.6 t30 -156.45 -49.18 0.07 Allowed 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.514 -0.312 . . . . 0.57 110.983 -176.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.439 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 8.2 p -122.3 11.63 10.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.319 -0.952 . . . . 0.76 111.337 -171.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 38.64 23.0 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 116.206 1.928 . . . . 1.9 116.206 174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -66.96 154.4 41.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.682 -0.858 . . . . 0.33 108.682 166.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 5' ' ' THR . 17.6 p -129.62 8.21 5.35 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.911 0.862 . . . . 0.42 109.339 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.56 74.28 1.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 114.212 -1.358 . . . . 1.26 109.647 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 17' ' ' LEU . 35.1 m -150.0 134.07 17.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.125 -0.489 . . . . 0.4 110.997 -175.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.9 m -97.79 -7.76 29.92 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.203 0.525 . . . . 0.54 110.838 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.699 ' H ' HG22 ' A' ' 15' ' ' THR . 19.6 tp -123.99 79.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.245 -0.434 . . . . 0.79 110.786 -173.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -86.17 95.47 9.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.413 0.625 . . . . 0.18 111.829 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -86.15 172.66 10.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.205 -0.907 . . . . 2.03 109.683 175.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.542 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.7 mmt-85 -104.11 148.42 26.29 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.862 0.363 . . . . 3.9 111.235 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -92.69 -169.35 2.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 118.501 -0.761 . . . . 0.2 109.027 171.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.702 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -53.77 -29.07 38.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.641 0.978 . . . . 0.36 113.641 -169.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.29 17.81 19.11 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.861 0.839 . . . . 1.61 108.842 -172.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.542 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 80.06 27.15 53.82 Favored Glycine 0 N--CA 1.438 -1.197 0 CA-C-N 114.602 -1.181 . . . . 0.22 112.645 176.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.1 142.99 26.91 Favored Pre-proline 0 C--N 1.327 -0.406 0 C-N-CA 120.243 -0.583 . . . . 1.27 109.858 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 18.2 Cg_endo -63.46 129.26 24.69 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 123.977 3.118 . . . . 0.21 112.926 -178.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.83 146.94 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 109.077 -0.712 . . . . 0.12 109.077 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.653 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.3 p -69.55 168.97 13.55 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.222 -1.029 . . . . 0.22 108.222 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.511 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -50.33 -56.28 11.97 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.976 0.807 . . . . 1.52 112.501 -173.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.32 -50.56 62.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 118.604 0.638 . . . . 0.21 112.669 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.526 ' SG ' HD11 ' A' ' 44' ' ' LEU . 68.1 m -68.4 -34.77 76.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 111.493 0.182 . . . . 0.41 111.493 -175.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.73 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -80.52 -30.6 39.83 Favored Glycine 0 C--O 1.222 -0.632 0 C-N-CA 120.215 -0.993 . . . . 0.46 112.905 174.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.2 tt -69.91 -46.8 64.62 Favored 'General case' 0 CA--C 1.5 -0.944 0 N-CA-C 108.408 -0.96 . . . . 0.54 108.408 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 44.2 t80 -70.46 -44.86 66.91 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 120.315 -0.554 . . . . 0.44 110.832 -171.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.702 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 86.7 t80 -59.42 -25.31 64.22 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.454 -0.794 . . . . 0.57 111.478 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.73 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.5 mptp? -76.1 -38.11 57.31 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 121.603 0.716 . . . . 1.23 110.031 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 10.1 mt -74.74 -38.25 62.31 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.304 -1.316 . . . . 1.19 110.467 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.465 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 50.0 m-70 -121.88 -2.05 9.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 114.552 1.315 . . . . 1.02 114.552 -165.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 63.55 20.24 12.14 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.884 0.327 . . . . 1.87 111.884 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -144.97 160.78 13.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 120.872 -0.331 . . . . 0.59 110.402 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.607 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.3 m-80 -67.66 160.2 28.43 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 123.387 0.429 . . . . 1.73 109.917 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.7 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.7 tmt_? -85.77 109.47 22.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.151 -0.685 . . . . 3.32 109.151 -174.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.79 118.93 5.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.011 1.808 . . . . 0.8 110.932 173.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 11.8 mt -121.69 -158.18 0.76 Allowed 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 109.143 -0.688 . . . . 1.8 109.143 -173.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.678 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 16.7 p -139.45 -157.76 0.8 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.9 -0.591 . . . . 3.21 110.27 -174.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 35.6 mtm -90.59 -163.3 1.0 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.901 -0.777 . . . . 6.47 108.901 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -70.93 -45.81 63.58 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.832 -0.803 . . . . 10.6 108.832 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmp? -92.01 49.92 1.6 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.536 -0.756 . . . . 10.22 111.046 176.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.678 ' O ' ' HB ' ' A' ' 45' ' ' THR . 44.3 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.338 -0.839 . . . . 7.0 111.72 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 90.9 mmm . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.76 0.314 . . . . 17.45 110.509 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -153.62 51.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.115 0.483 . . . . 15.75 110.076 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.92 66.3 4.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.013 -0.539 . . . . 15.5 110.484 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -118.42 21.78 12.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.351 0.596 . . . . 14.5 109.666 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 60.6 t60 -145.78 92.46 2.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.168 -0.924 . . . . 12.71 109.268 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -62.37 144.62 55.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.949 0.404 . . . . 11.69 110.74 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -119.31 119.27 33.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.182 -0.463 . . . . 9.77 110.17 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -79.41 75.49 6.01 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.774 -0.648 . . . . 9.59 110.049 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 37.6 m -84.85 103.13 13.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.876 -0.602 . . . . 7.05 110.619 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 24.7 m -131.08 61.4 1.64 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.037 -0.529 . . . . 6.01 110.244 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -71.92 -20.96 79.13 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.743 -0.662 . . . . 2.88 112.317 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.558 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 67.6 mt 67.19 71.35 0.36 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.11 0.564 . . . . 2.25 110.803 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -162.54 143.97 10.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 3.44 110.315 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.568 HG23 ' HG ' ' A' ' 33' ' ' LEU . 4.0 p -127.07 -12.97 3.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.499 -0.319 . . . . 1.67 110.4 177.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 75.52 -64.38 0.37 Allowed 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.335 0.654 . . . . 3.12 112.209 176.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 18.8 p90 -89.31 58.43 4.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.64 0.607 . . . . 2.17 112.64 -171.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.475 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 54.3 tp60 -177.96 120.8 0.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 2.74 109.396 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -76.53 123.78 6.88 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 121.005 -0.617 . . . . 1.43 113.342 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -95.51 156.36 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.532 2.821 . . . . 2.08 112.608 175.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -173.48 96.13 0.11 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.649 -0.251 . . . . 5.35 111.225 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.441 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 2.1 mtt180 164.7 156.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 2.94 108.781 177.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.71 -62.97 0.8 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.231 0.456 . . . . 1.09 112.231 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.25 56.59 3.2 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.936 -0.65 . . . . 0.54 112.106 -177.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.728 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.0 m -119.96 -177.64 3.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.346 -0.502 . . . . 0.38 111.148 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.728 ' H ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -124.07 151.4 43.89 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.781 0.433 . . . . 0.86 111.053 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 9' ' ' ASN . 36.4 t -84.07 124.94 31.63 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.078 -0.51 . . . . 0.21 111.774 -171.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.81 25.17 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.911 1.284 . . . . 0.31 113.972 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.491 ' H ' ' C ' ' A' ' 7' ' ' CYS . 18.3 t30 -158.57 -44.01 0.06 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.785 -0.189 . . . . 0.57 111.408 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.1 p -123.62 5.04 8.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 118.946 -1.101 . . . . 0.76 112.012 -174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 44.13 22.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.458 1.651 . . . . 1.9 115.458 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -67.93 154.5 41.45 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.62 -0.881 . . . . 0.33 108.62 166.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 27.6 p -128.87 1.69 5.37 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.789 0.804 . . . . 0.42 110.014 176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.61 67.93 3.97 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.781 -1.1 . . . . 1.26 109.722 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 17' ' ' LEU . 3.0 m -142.92 133.83 25.51 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.175 -0.61 . . . . 0.4 110.877 -176.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -96.17 1.64 52.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.029 -0.532 . . . . 0.54 110.512 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.705 ' H ' HG22 ' A' ' 15' ' ' THR . 14.8 tp -131.8 88.19 2.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.403 -0.362 . . . . 0.79 111.265 -173.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.407 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 88.7 m95 -95.31 96.09 8.92 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.658 0.742 . . . . 0.18 111.666 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.634 ' HE ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.51 171.55 10.44 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.752 -1.113 . . . . 2.03 109.498 175.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.519 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 6.5 mmt-85 -101.66 148.94 24.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.83 0.348 . . . . 3.9 110.917 173.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -93.48 -171.48 2.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.574 -0.898 . . . . 0.2 108.574 170.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.18 -28.69 42.17 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.697 0.999 . . . . 0.36 113.697 -169.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -109.11 17.18 21.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.344 -0.984 . . . . 1.61 108.344 -172.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.83 28.38 59.06 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 114.484 -1.235 . . . . 0.22 112.549 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.497 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -94.1 143.82 27.05 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 120.27 -0.572 . . . . 1.27 110.142 -179.293 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -63.18 131.49 32.57 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 124.04 3.16 . . . . 0.21 113.231 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.41 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -142.16 148.68 20.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.293 -0.632 . . . . 0.12 109.293 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 4.3 p -70.74 170.6 12.08 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.309 -0.997 . . . . 0.22 108.309 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.615 HD21 HD13 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -51.64 -54.93 22.63 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 119.211 0.914 . . . . 1.52 111.779 -174.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.08 -50.99 60.47 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.744 0.646 . . . . 0.21 112.744 -177.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 77.1 m -69.01 -37.26 78.57 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 111.661 0.245 . . . . 0.41 111.661 -175.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -73.74 -37.88 50.98 Favored Glycine 0 C--O 1.222 -0.619 0 C-N-CA 120.337 -0.935 . . . . 0.46 111.952 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 5.0 tt -70.24 -41.82 73.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.094 -0.706 . . . . 0.54 109.094 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.723 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 63.0 t80 -69.01 -43.11 75.48 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 115.797 -0.638 . . . . 0.44 111.054 -173.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -61.87 -27.85 69.08 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.937 -0.574 . . . . 0.57 110.056 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.2 OUTLIER -71.42 -34.95 70.79 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-O 121.687 0.756 . . . . 1.23 110.222 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.3 mt -77.55 -43.24 32.52 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 114.591 -1.186 . . . . 1.19 110.357 178.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.44 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.9 m170 -121.97 0.62 9.73 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 114.601 1.334 . . . . 1.02 114.601 -161.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 26.79 15.73 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.153 0.427 . . . . 1.87 112.153 176.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 38' ' ' HIS . 2.0 m -152.53 161.24 2.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.252 -0.431 . . . . 0.59 109.914 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.689 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 21.2 m-80 -73.0 164.64 26.4 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.409 -0.219 . . . . 1.73 110.409 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.723 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 19.0 tpt180 -94.04 105.0 14.97 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.018 -0.537 . . . . 3.32 110.414 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.689 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.2 Cg_exo -62.47 119.43 6.52 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.314 2.009 . . . . 0.8 112.03 174.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.613 ' CD2' ' HG3' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -127.07 -96.05 0.43 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.212 -0.903 . . . . 1.8 110.499 177.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.3 m 67.82 -83.75 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.804 -1.089 . . . . 3.21 111.323 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.4 tpt -149.75 -66.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.073 0.463 . . . . 6.47 111.372 -179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 62.9 tttm -151.65 59.98 0.87 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.629 -0.714 . . . . 10.6 110.681 -174.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 43.87 49.08 7.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.613 0.968 . . . . 10.22 113.613 -177.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 47' ' ' LYS . 52.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 109.185 -0.672 . . . . 7.0 109.185 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 109.719 -0.474 . . . . 17.45 109.719 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -130.33 18.77 5.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.881 0.372 . . . . 15.75 111.296 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -82.2 107.65 15.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.892 0.377 . . . . 15.5 110.815 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -139.91 150.13 44.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.697 -0.683 . . . . 14.5 109.552 171.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . 0.465 ' O ' ' HB2' ' A' ' -13' ' ' HIS . 39.2 m80 71.4 126.02 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 O-C-N 124.127 0.892 . . . . 12.71 110.389 -176.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . 0.465 ' HB2' ' O ' ' A' ' -14' ' ' HIS . 52.5 m-70 71.77 117.06 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.626 -0.715 . . . . 11.69 111.525 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -99.51 155.17 17.71 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.924 -0.58 . . . . 9.77 110.023 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -77.3 72.69 3.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.084 0.469 . . . . 9.59 110.393 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.7 p -80.69 60.52 4.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.481 0.658 . . . . 7.05 110.379 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 41.3 m -145.5 133.09 20.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.55 -0.75 . . . . 6.01 110.174 -178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 171.07 -56.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 110.728 -0.949 . . . . 2.88 110.728 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.563 HD12 ' H ' ' A' ' -7' ' ' LEU . 1.1 mp -92.69 79.71 4.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.834 -1.173 . . . . 2.25 107.834 174.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.75 -83.27 0.4 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.987 -0.552 . . . . 3.44 111.686 -173.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.719 ' HB ' HD12 ' A' ' 33' ' ' LEU . 3.9 p 37.91 60.44 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 122.467 1.127 . . . . 1.67 110.653 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.09 43.4 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.165 -0.925 . . . . 3.12 113.086 -169.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.542 ' CE2' ' HB3' ' A' ' 36' ' ' LYS . 9.0 p90 -143.4 41.65 1.48 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.509 0.671 . . . . 2.17 110.368 177.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.625 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 7.5 tp-100 -172.34 160.09 4.87 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.073 -0.967 . . . . 2.74 108.857 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.485 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . -41.34 127.11 3.57 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 123.825 0.703 . . . . 1.43 113.607 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . 0.485 ' HD3' ' HA2' ' A' ' -1' ' ' GLY . 24.1 Cg_exo -63.32 -75.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.232 2.621 . . . . 2.08 114.212 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 6.5 ppt_? -150.7 -174.73 4.86 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 112.373 0.509 . . . . 5.35 112.373 -173.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.75 17.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.267 -0.424 . . . . 2.94 110.859 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.55 -106.12 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.952 0.723 . . . . 1.09 112.952 175.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.96 74.24 0.25 Allowed Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.107 -1.044 . . . . 0.54 112.184 -174.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.715 ' O ' HG22 ' A' ' 13' ' ' THR . 0.7 OUTLIER -110.01 -172.68 2.09 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.818 -0.691 . . . . 0.38 109.926 -178.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.597 ' H ' HG22 ' A' ' 5' ' ' THR . 1.2 p -122.74 148.84 44.86 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.223 0.209 . . . . 0.86 111.137 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.586 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.3 t -79.62 127.81 32.62 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 120.168 -0.613 . . . . 0.21 111.137 -173.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 23.84 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.112 0.965 . . . . 0.31 112.469 174.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.586 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.0 t30 -154.24 -42.01 0.09 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.649 -0.705 . . . . 0.57 111.364 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.579 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.8 m -113.65 -5.01 13.38 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.513 0.56 . . . . 0.76 112.513 -175.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.622 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 16.8 tt0 47.59 10.26 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.277 1.031 . . . . 1.9 113.529 -172.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.432 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.1 t -65.95 151.51 46.61 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 108.977 -0.749 . . . . 0.33 108.977 174.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.715 HG22 ' O ' ' A' ' 5' ' ' THR . 21.5 p -121.98 2.59 9.92 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.898 0.856 . . . . 0.42 109.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.62 75.87 3.25 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.376 -1.284 . . . . 1.26 109.96 176.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.65 HG21 ' HA ' ' A' ' 28' ' ' CYS . 39.0 m -150.77 134.52 16.57 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.618 -0.433 . . . . 0.4 110.978 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -91.59 -11.33 37.51 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.228 0.455 . . . . 0.54 112.228 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.624 ' HG ' ' HE ' ' A' ' 19' ' ' ARG . 9.8 tp -131.21 89.91 2.8 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 120.339 -0.544 . . . . 0.79 111.06 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.584 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.7 m95 -86.75 97.97 10.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.074 -0.512 . . . . 0.18 111.745 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.625 ' NH1' ' HB3' ' A' ' -2' ' ' GLN . 0.0 OUTLIER -89.71 172.55 8.85 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.293 -0.867 . . . . 2.03 109.99 175.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.5 mmt85 -104.5 147.97 26.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.015 0.436 . . . . 3.9 111.553 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -94.81 -169.11 1.94 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.399 -0.819 . . . . 0.2 109.165 172.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.56 -8.43 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.496 0.924 . . . . 0.36 113.496 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -110.88 6.54 21.31 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.593 -0.891 . . . . 1.61 108.593 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.512 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 70.32 23.56 77.31 Favored Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 110.144 -1.182 . . . . 0.22 110.144 -172.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.48 140.98 25.51 Favored Pre-proline 0 CA--C 1.512 -0.49 0 CA-C-O 121.271 0.558 . . . . 1.27 109.657 -174.482 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.499 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 26.3 Cg_endo -64.23 131.33 29.93 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 123.942 3.095 . . . . 0.21 112.843 -176.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -139.49 147.39 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.991 0.424 . . . . 0.12 110.314 -178.684 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.65 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.7 p -70.24 163.89 25.49 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.627 -0.879 . . . . 0.22 108.627 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.405 ' ND2' ' HB2' ' A' ' 33' ' ' LEU . 1.5 t-20 -44.08 -58.25 2.93 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-N 119.065 0.848 . . . . 1.52 112.224 -171.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.06 -39.26 63.16 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 112.088 0.403 . . . . 0.21 112.088 -174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 90.8 m -73.97 -44.39 54.94 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.692 0.626 . . . . 0.41 112.692 -174.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -78.23 -23.76 65.09 Favored Glycine 0 C--O 1.217 -0.915 0 C-N-CA 119.012 -1.566 . . . . 0.46 111.396 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.817 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.1 tt -72.62 -46.32 54.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.83 -1.174 . . . . 0.54 107.83 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.606 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 57.7 t80 -68.99 -52.43 28.95 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.97 -0.559 . . . . 0.44 111.559 -173.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -56.36 -26.28 52.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.194 -0.457 . . . . 0.57 110.873 178.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.562 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -79.59 -25.42 41.54 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.861 0.838 . . . . 1.23 110.289 -177.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.817 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 11.9 mt -85.38 -39.86 17.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.425 -1.261 . . . . 1.19 110.634 176.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 34' ' ' TYR . 64.4 m-70 -122.22 -2.13 9.13 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.436 1.272 . . . . 1.02 114.436 -166.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 55.49 36.21 26.68 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.206 0.817 . . . . 1.87 113.206 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.434 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -151.38 163.53 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.969 -0.559 . . . . 0.59 109.768 175.58 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.626 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 12.7 m-80 -66.74 161.6 23.2 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.236 0.335 . . . . 1.73 110.11 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.606 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.9 OUTLIER -93.84 104.55 13.39 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 109.062 -0.718 . . . . 3.32 109.062 -174.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.626 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.2 Cg_exo -53.42 117.64 4.02 Favored 'Trans proline' 0 CA--C 1.511 -0.638 0 C-N-CA 121.622 1.548 . . . . 0.8 109.628 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' SG ' ' A' ' 10' ' ' CYS . 7.3 tp -153.33 -71.92 0.14 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.606 -0.725 . . . . 1.8 110.845 -166.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.9 p -134.8 -104.8 0.23 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.052 -0.522 . . . . 3.21 110.776 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.415 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 40.7 tpp -167.73 158.74 11.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.648 -0.871 . . . . 6.47 108.648 175.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 25.5 ttpp -47.91 -50.45 26.74 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.512 0.507 . . . . 10.6 110.547 -178.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -134.24 85.48 2.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.488 . . . . 10.22 109.861 173.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 46' ' ' MET . 42.6 tt0 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.417 -0.801 . . . . 7.0 110.076 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.871 0.367 . . . . 17.45 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.18 -74.56 0.2 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.909 -0.587 . . . . 15.75 110.397 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 45.9 m80 51.9 55.99 8.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.985 -0.552 . . . . 15.5 111.491 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -123.22 156.09 35.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.965 -0.562 . . . . 14.5 109.905 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 63.95 -87.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.587 0.554 . . . . 12.71 110.975 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 16.2 m-70 51.79 55.94 8.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.347 0.594 . . . . 11.69 111.62 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -93.59 75.21 4.39 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.647 -0.706 . . . . 9.77 109.67 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -76.87 -31.91 57.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 9.59 110.199 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 14.5 m -66.46 129.11 38.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 7.05 110.726 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 19.9 m -69.51 135.96 50.79 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.493 -0.558 . . . . 6.01 109.493 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -84.82 156.04 30.99 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.734 -0.746 . . . . 2.88 112.636 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' -7' ' ' LEU . 0.2 OUTLIER -74.74 78.91 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.357 0.598 . . . . 2.25 109.895 178.453 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -131.22 55.71 1.84 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.239 -0.891 . . . . 3.44 110.453 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.554 ' HB ' HD12 ' A' ' 33' ' ' LEU . 5.0 p -141.75 50.28 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.702 1.239 . . . . 1.67 109.2 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -80.58 3.16 22.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.881 -1.054 . . . . 3.12 111.908 -173.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -83.91 -12.48 55.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.655 -0.248 . . . . 2.17 111.237 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -162.56 113.5 1.53 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.539 0.209 . . . . 2.74 111.411 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 128.5 139.81 4.84 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.689 -0.767 . . . . 1.43 113.314 175.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 66.0 Cg_endo -92.47 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.339 2.693 . . . . 2.08 112.645 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -138.0 165.61 26.14 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.233 -0.654 . . . . 5.35 109.233 173.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.464 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 51.6 ttt180 -151.37 21.76 0.73 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.574 -0.45 . . . . 2.94 111.592 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.83 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.249 1.203 . . . . 1.09 114.249 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -122.96 53.03 0.75 Allowed Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.001 -0.619 . . . . 0.54 113.285 -169.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.2 m -89.07 -169.19 2.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.35 -0.241 . . . . 0.38 110.35 177.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.662 ' H ' HG22 ' A' ' 5' ' ' THR . 4.8 p -119.28 149.31 42.0 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.309 0.244 . . . . 0.86 111.112 171.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.8 t -79.88 129.87 34.84 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.244 -0.582 . . . . 0.21 111.006 -176.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.51 25.31 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.374 1.07 . . . . 0.31 112.904 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.543 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.4 t30 -160.6 -43.27 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.764 0.426 . . . . 0.57 111.264 -173.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 44' ' ' LEU . 5.3 m -112.35 -5.45 14.12 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.589 -0.444 . . . . 0.76 112.131 -175.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 44.6 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.129 1.159 . . . . 1.9 114.129 -173.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -67.2 150.04 49.64 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.271 -0.64 . . . . 0.33 109.271 173.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.0 p -128.55 22.37 5.96 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 122.079 0.943 . . . . 0.42 109.066 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 14' ' ' THR . 12.5 t -121.06 70.79 0.92 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.967 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' H ' ' A' ' 17' ' ' LEU . 25.0 m -149.13 138.56 21.65 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.497 -1.229 . . . . 0.4 109.34 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 m -98.46 -13.13 20.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.081 0.467 . . . . 0.54 111.544 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.676 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 21.3 tp -121.87 80.18 1.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.408 -0.517 . . . . 0.79 111.181 -169.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.464 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 90.2 m95 -87.5 95.9 10.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.749 -0.66 . . . . 0.18 112.128 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -89.55 173.11 8.5 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 115.648 -0.705 . . . . 2.03 110.123 174.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 9.7 mmt-85 -102.82 148.67 25.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.015 0.436 . . . . 3.9 111.522 175.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -94.24 -169.88 2.16 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.386 -0.816 . . . . 0.2 108.922 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.07 -20.67 26.35 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.127 0.876 . . . . 0.36 113.349 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -101.04 0.62 38.34 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.418 -0.956 . . . . 1.61 108.418 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 78.1 25.59 61.6 Favored Glycine 0 N--CA 1.433 -1.546 0 CA-C-N 114.758 -1.11 . . . . 0.22 110.408 -172.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.467 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -92.47 141.15 24.42 Favored Pre-proline 0 CA--C 1.516 -0.345 0 CA-C-O 121.204 0.526 . . . . 1.27 109.88 -175.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -63.54 131.9 33.47 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 124.006 3.137 . . . . 0.21 112.889 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.563 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.54 149.22 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 CA-C-O 121.0 0.429 . . . . 0.12 110.507 -179.469 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HA ' HG21 ' A' ' 15' ' ' THR . 9.4 p -68.91 164.47 22.05 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.082 -1.081 . . . . 0.22 108.082 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.52 -53.81 21.39 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 119.281 0.946 . . . . 1.52 111.429 -173.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -42.95 61.33 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.525 0.516 . . . . 0.21 112.201 -177.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.716 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 86.9 m -72.8 -45.64 57.45 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.562 0.578 . . . . 0.41 112.562 -177.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.721 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -70.2 -27.61 72.63 Favored Glycine 0 C--O 1.216 -0.973 0 C-N-CA 119.166 -1.492 . . . . 0.46 110.963 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.8 tt -74.72 -45.11 46.38 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 108.901 -0.778 . . . . 0.54 108.901 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HE1' HG23 ' A' ' 40' ' ' VAL . 38.8 t80 -71.82 -42.12 67.4 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 116.164 -0.471 . . . . 0.44 111.414 -173.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -61.75 -26.78 68.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.889 0.376 . . . . 0.57 110.558 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.721 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 9.4 mptt -72.22 -34.38 68.29 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.762 0.791 . . . . 1.23 109.987 -178.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -79.32 -42.08 26.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.525 -1.216 . . . . 1.19 110.257 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.3 m170 -121.52 -1.81 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.13 1.159 . . . . 1.02 114.13 -162.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.15 30.55 19.41 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.633 0.373 . . . . 1.87 111.972 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.593 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -151.29 162.2 3.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.53 -0.305 . . . . 0.59 110.609 -178.25 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.585 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 27.7 m-80 -68.62 162.72 25.31 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.119 -0.491 . . . . 1.73 109.877 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.716 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 7.5 tpt180 -90.7 110.43 41.44 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.19 -0.459 . . . . 3.32 110.433 -174.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.585 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 72.9 Cg_exo -56.43 116.9 3.52 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.553 1.502 . . . . 0.8 109.199 169.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.528 HD23 ' SG ' ' A' ' 10' ' ' CYS . 3.0 tp -153.36 -85.25 0.07 Allowed 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.747 -0.66 . . . . 1.8 110.518 -168.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.4 ' H ' ' HB3' ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.83 -101.11 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.197 0.936 . . . . 3.21 112.474 -178.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 36.8 tpp -116.27 166.35 12.14 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.962 -0.755 . . . . 6.47 108.962 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -46.58 -42.49 16.09 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.289 0.368 . . . . 10.6 111.441 -176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -133.68 75.93 1.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.226 0.536 . . . . 10.22 110.388 172.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.684 -0.674 . . . . 7.0 109.19 176.056 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.6 mpp? . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.329 -0.249 . . . . 17.45 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.34 57.42 4.45 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.726 0.641 . . . . 15.75 111.954 177.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 66.2 m80 59.57 48.55 9.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.816 -0.629 . . . . 15.5 111.353 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -83.65 71.61 10.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.994 0.426 . . . . 14.5 110.201 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.98 132.3 46.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 12.71 110.257 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -81.3 133.35 35.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.157 -0.474 . . . . 11.69 110.948 -175.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -97.34 93.34 6.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 9.77 110.185 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -87.7 54.63 3.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.395 0.617 . . . . 9.59 109.97 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 20.4 m -82.71 75.32 9.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.842 -0.617 . . . . 7.05 110.219 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.4 m -84.33 10.27 11.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.694 -0.684 . . . . 6.01 110.58 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 113.08 -4.63 25.49 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.969 -0.852 . . . . 2.88 110.969 -174.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.643 ' HB2' HD22 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -162.93 146.81 11.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.204 -0.498 . . . . 2.25 110.477 178.003 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -143.65 -61.29 0.4 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.418 -0.355 . . . . 3.44 111.18 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.581 ' HB ' HD12 ' A' ' 33' ' ' LEU . 2.7 p -53.92 104.4 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.454 0.645 . . . . 1.67 112.07 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 2.1 pp -127.75 6.89 6.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.167 0.508 . . . . 3.12 110.774 177.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -88.14 -15.95 34.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 2.17 111.33 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -155.52 91.46 1.32 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.577 -0.283 . . . . 2.74 110.538 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 145.19 132.09 2.43 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.679 -0.772 . . . . 1.43 112.948 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -89.68 -144.12 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.633 2.889 . . . . 2.08 112.507 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -134.63 150.77 50.7 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 110.189 -0.3 . . . . 5.35 110.189 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.535 ' HB3' ' OG1' ' A' ' 5' ' ' THR . 25.9 mmt180 -116.85 -17.55 10.42 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.321 -0.399 . . . . 2.94 110.657 -178.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.22 -111.56 0.06 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.62 0.768 . . . . 1.09 112.333 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.61 60.03 4.89 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 121.348 -0.453 . . . . 0.54 112.5 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.7 m -120.76 -179.54 4.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 117.122 0.461 . . . . 0.38 110.586 -174.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 5' ' ' THR . 0.7 OUTLIER -119.09 153.92 34.01 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.845 0.355 . . . . 0.86 111.551 178.055 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.9 t -84.42 122.1 28.49 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 116.149 -0.478 . . . . 0.21 110.063 -177.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -11.99 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.09 0.956 . . . . 0.31 113.166 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 7' ' ' CYS . 19.1 t30 -126.94 -41.76 1.79 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.52 0.563 . . . . 0.57 112.52 -166.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.8 p -118.11 3.6 12.05 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 119.346 -0.942 . . . . 0.76 111.125 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 51.85 11.64 0.15 Allowed 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.902 1.445 . . . . 1.9 114.902 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.6 t -60.83 151.17 30.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 118.957 0.799 . . . . 0.33 109.629 170.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 5' ' ' THR . 14.8 p -129.52 9.19 5.5 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.222 -0.899 . . . . 0.42 110.296 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -106.28 68.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.756 1.265 . . . . 1.26 109.197 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.1 m -144.72 141.81 29.55 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.748 -1.115 . . . . 0.4 110.208 -174.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.0 m -108.73 2.31 21.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.54 110.817 -177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.643 HD22 ' HB2' ' A' ' -7' ' ' LEU . 12.7 tp -130.25 72.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.011 0.434 . . . . 0.79 110.358 -169.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.491 ' CG ' ' HB2' ' A' ' 2' ' ' ARG . 94.7 m95 -82.89 97.91 8.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.419 0.628 . . . . 0.18 112.532 -174.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.714 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -82.87 171.3 14.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.077 -0.965 . . . . 2.03 109.475 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.64 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 30.6 mtt180 -103.85 149.3 25.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 120.932 0.396 . . . . 3.9 110.574 172.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -99.24 -171.95 2.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 118.034 -0.984 . . . . 0.2 108.954 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.98 -25.89 45.95 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.539 0.94 . . . . 0.36 113.539 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.85 0.63 30.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.209 1.004 . . . . 1.61 108.46 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 86.27 28.26 28.32 Favored Glycine 0 N--CA 1.432 -1.604 0 CA-C-N 113.941 -1.481 . . . . 0.22 111.381 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 62.0 m-20 -85.43 161.11 52.5 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.486 -0.561 . . . . 1.27 109.486 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 37.7 Cg_endo -76.65 132.53 13.36 Favored 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 122.823 2.348 . . . . 0.21 112.809 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.63 151.43 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB2' HG21 ' A' ' 15' ' ' THR . 7.0 p -71.75 171.36 11.74 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 108.291 -1.003 . . . . 0.22 108.291 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.522 HD21 HD13 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -48.27 -57.54 5.82 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.966 0.803 . . . . 1.52 112.271 -174.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.2 -50.89 71.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.991 0.737 . . . . 0.21 112.991 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 79.2 m -60.37 -38.94 85.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.211 0.449 . . . . 0.41 112.211 -174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.714 ' HA3' ' HG3' ' A' ' 19' ' ' ARG . . . -80.05 -40.3 14.41 Favored Glycine 0 C--O 1.224 -0.49 0 C-N-CA 119.354 -1.403 . . . . 0.46 111.663 174.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.674 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 4.0 tt -57.6 -41.61 81.55 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 109.481 -0.563 . . . . 0.54 109.481 -178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.23 -48.77 74.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.797 -0.761 . . . . 0.44 111.142 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -61.89 -25.31 67.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.831 -0.622 . . . . 0.57 110.022 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 12.1 mptt -72.88 -37.16 67.41 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.648 0.737 . . . . 1.23 110.033 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 15.9 mt -77.33 -39.26 48.3 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.613 -1.176 . . . . 1.19 111.171 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -120.9 -6.45 9.56 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.227 1.195 . . . . 1.02 114.227 -164.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.03 36.79 21.43 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.056 0.542 . . . . 1.87 112.202 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.3 m -150.99 169.68 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.59 111.679 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.5 m-80 -56.97 162.98 2.18 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.142 -0.936 . . . . 1.73 110.508 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.53 97.38 16.53 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.073 -0.512 . . . . 3.32 110.772 -167.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.663 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 32.5 Cg_exo -63.17 118.93 5.83 Favored 'Trans proline' 0 CA--C 1.507 -0.872 0 C-N-CA 122.604 2.203 . . . . 0.8 109.663 173.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.0 tp -165.57 -72.53 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 120.104 -0.638 . . . . 1.8 112.187 -165.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 49' ' ' GLU . 5.2 p -146.14 -152.83 0.45 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.835 -0.62 . . . . 3.21 110.242 -174.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.412 ' H ' ' HB ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -95.54 -162.7 0.97 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.126 -0.694 . . . . 6.47 109.126 175.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -68.06 -28.34 67.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.161 0.505 . . . . 10.6 109.982 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -149.81 93.78 2.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.399 -0.818 . . . . 10.22 109.898 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' A' ' 45' ' ' THR . 4.0 mp0 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.41 -0.805 . . . . 7.0 110.739 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.0 ptm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.7 0.286 . . . . 17.45 110.333 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -147.14 114.68 6.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.173 -0.467 . . . . 15.75 110.114 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -76.49 113.05 13.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.301 -0.409 . . . . 15.5 110.032 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -88.75 93.99 9.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.984 -0.376 . . . . 14.5 109.984 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -58.13 132.87 54.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 12.71 110.325 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -81.16 117.75 21.98 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.968 -0.56 . . . . 11.69 110.889 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . 0.463 ' O ' ' HB2' ' A' ' -9' ' ' SER . 39.8 m-70 -74.48 -1.44 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.693 -0.685 . . . . 9.77 111.096 -176.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -64.32 -30.02 71.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.268 0.556 . . . . 9.59 109.522 170.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.2 m -93.48 47.43 1.24 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.738 -0.664 . . . . 7.05 109.827 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' -12' ' ' HIS . 13.5 t -86.5 -50.17 7.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.897 -0.592 . . . . 6.01 109.985 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . 0.423 ' HA3' HD11 ' A' ' -4' ' ' LEU . . . -104.71 163.56 14.61 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.536 -0.84 . . . . 2.88 111.717 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.462 ' CD1' ' HB ' ' A' ' 16' ' ' THR . 10.3 mp -86.04 41.45 0.92 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.869 0.366 . . . . 2.25 110.964 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.526 ' HG3' ' H ' ' A' ' -5' ' ' VAL . 6.7 tp10 61.55 -172.66 0.14 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.816 -0.629 . . . . 3.44 110.499 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.605 HG21 ' HA ' ' A' ' 33' ' ' LEU . 14.2 p 46.52 34.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 122.182 0.991 . . . . 1.67 111.676 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . 0.423 HD11 ' HA3' ' A' ' -8' ' ' GLY . 69.7 mt -82.01 83.89 7.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.516 -0.765 . . . . 3.12 110.815 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -164.16 -41.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 2.17 111.32 176.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -134.55 90.64 2.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.209 -0.196 . . . . 2.74 110.59 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 155.0 139.34 2.77 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.448 -0.882 . . . . 1.43 113.032 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -87.7 -159.89 0.1 OUTLIER 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.424 2.749 . . . . 2.08 112.638 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -142.26 168.05 20.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.592 . . . . 5.35 109.719 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.2 ttt-85 -158.89 176.11 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.858 -0.793 . . . . 2.94 108.858 -175.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.38 165.51 27.21 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.529 -0.468 . . . . 1.09 110.348 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.86 40.04 56.74 Favored Glycine 0 C--N 1.35 1.321 0 C-N-CA 121.099 -0.572 . . . . 0.54 113.108 -175.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.516 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 m -121.06 170.56 9.41 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.822 0.311 . . . . 0.38 111.116 -173.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 5' ' ' THR . 1.1 p -128.09 150.73 49.83 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.748 0.309 . . . . 0.86 111.18 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.485 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.5 t -83.7 125.86 32.3 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.303 -0.408 . . . . 0.21 111.452 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.19 25.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.003 1.321 . . . . 0.31 113.525 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.485 ' H ' ' C ' ' A' ' 7' ' ' CYS . 37.4 t30 -158.3 -46.25 0.06 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 116.555 -0.293 . . . . 0.57 111.27 -174.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.521 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 12.5 p -123.85 6.7 8.7 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.484 -0.887 . . . . 0.76 112.308 -173.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 46.82 16.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.872 1.804 . . . . 1.9 115.872 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -63.15 146.51 53.17 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 118.877 0.762 . . . . 0.33 109.03 168.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 5' ' ' THR . 26.4 p -127.45 16.88 7.06 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.348 -0.842 . . . . 0.42 109.869 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 14' ' ' THR . 9.0 t -116.26 70.43 0.76 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.555 -1.202 . . . . 1.26 109.037 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.635 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.7 m -141.93 132.22 24.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.023 -0.989 . . . . 0.4 110.923 -173.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.462 ' HB ' ' CD1' ' A' ' -7' ' ' LEU . 6.4 m -90.36 -10.65 43.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.065 -0.516 . . . . 0.54 111.584 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' THR . 15.3 tp -130.24 91.7 3.15 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.097 0.475 . . . . 0.79 110.896 -174.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -90.31 95.66 10.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.51 0.672 . . . . 0.18 111.235 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HE ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.73 171.52 10.87 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.934 -1.03 . . . . 2.03 109.792 177.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 11.6 mmt-85 -106.95 147.72 29.5 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 120.722 0.296 . . . . 3.9 111.503 175.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -94.15 -169.91 2.18 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.97 -0.752 . . . . 0.2 108.97 172.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.01 -22.2 25.73 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.669 0.989 . . . . 0.36 113.669 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -102.19 3.38 38.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.196 -1.039 . . . . 1.61 108.196 -173.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.517 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 76.54 24.84 66.78 Favored Glycine 0 N--CA 1.436 -1.351 0 CA-C-N 114.795 -1.093 . . . . 0.22 110.388 -174.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.91 132.22 30.14 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.728 -0.471 . . . . 1.27 109.728 -176.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -58.28 137.54 81.1 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.749 2.966 . . . . 0.21 113.926 -172.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -143.83 151.5 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 109.352 -0.61 . . . . 0.12 109.352 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.526 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.4 p -75.2 169.63 17.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.61 -0.885 . . . . 0.22 108.61 -178.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.454 ' H ' HG21 ' A' ' 15' ' ' THR . 0.9 OUTLIER -38.3 -60.46 0.78 Allowed 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 112.585 0.587 . . . . 1.52 112.585 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.97 75.59 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.086 0.773 . . . . 0.21 113.086 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 44' ' ' LEU . 33.6 m -71.52 -28.72 64.08 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.491 -0.483 . . . . 0.41 111.614 -173.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.595 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -78.76 -46.19 8.76 Favored Glycine 0 C--O 1.223 -0.531 0 C-N-CA 119.932 -1.128 . . . . 0.46 111.564 170.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.605 ' HA ' HG21 ' A' ' -5' ' ' VAL . 7.5 tt -60.44 -41.87 94.91 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 109.585 -0.524 . . . . 0.54 109.585 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -70.55 -41.93 71.81 Favored 'General case' 0 N--CA 1.42 -1.957 0 C-N-CA 119.716 -0.794 . . . . 0.44 110.906 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' HD1' ' C ' ' A' ' 40' ' ' VAL . 79.0 t80 -67.04 -25.77 66.43 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.084 -0.507 . . . . 0.57 111.472 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 5.0 mptp? -79.0 -20.3 49.41 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 122.348 1.071 . . . . 1.23 109.543 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -95.22 -42.25 8.65 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 113.042 -1.89 . . . . 1.19 110.104 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -120.08 -0.21 10.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.132 -0.94 . . . . 1.02 113.492 -166.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 63.98 19.31 11.69 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.938 0.718 . . . . 1.87 112.938 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.411 ' C ' ' HD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -145.44 163.76 11.78 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 109.772 -0.455 . . . . 0.59 109.772 174.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.525 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -68.64 161.23 28.57 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.605 -0.517 . . . . 1.73 109.605 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 tpt180 -82.99 115.61 59.78 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.465 -0.334 . . . . 3.32 110.154 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.525 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 60.6 Cg_exo -57.61 125.68 19.48 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.877 1.718 . . . . 0.8 110.747 168.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 6.4 mt -133.63 -144.02 0.22 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.537 -0.756 . . . . 1.8 109.174 -173.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 39.5 m 75.66 -55.31 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.754 0.659 . . . . 3.21 111.85 175.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 51.5 tpp -164.57 -62.57 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.405 -0.816 . . . . 6.47 110.497 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -167.95 48.24 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.659 -1.155 . . . . 10.6 109.427 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? 58.69 82.72 0.13 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.835 -0.62 . . . . 10.22 109.549 -171.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.616 -0.707 . . . . 7.0 110.146 -179.575 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.836 0.35 . . . . 17.45 110.633 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -96.63 48.42 1.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.955 0.407 . . . . 15.75 111.012 -178.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -138.5 143.98 39.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.151 -0.477 . . . . 15.5 109.76 177.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -113.39 63.69 0.64 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.676 0.75 . . . . 14.5 111.045 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -121.15 55.61 1.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.172 -0.922 . . . . 12.71 109.64 174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -91.35 -36.88 13.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.954 -0.566 . . . . 11.69 110.215 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -84.57 -38.66 19.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.708 -0.678 . . . . 9.77 109.667 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -89.99 103.86 16.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.757 -0.656 . . . . 9.59 109.946 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 30.6 m 66.61 -170.91 0.19 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.732 0.645 . . . . 7.05 110.587 -177.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 18.1 m 73.23 -53.73 0.7 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.339 0.655 . . . . 6.01 111.93 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -61.47 -24.46 63.87 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 121.587 -0.339 . . . . 2.88 113.411 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.683 ' H ' HD23 ' A' ' -7' ' ' LEU . 2.5 pt? -78.26 50.7 0.94 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.505 0.669 . . . . 2.25 111.062 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.04 -11.62 59.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.466 -0.788 . . . . 3.44 111.213 -175.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.536 ' HB ' HD12 ' A' ' 33' ' ' LEU . 7.4 p -76.02 85.0 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 122.059 0.933 . . . . 1.67 110.471 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.5 pp -95.81 21.98 7.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.703 -0.68 . . . . 3.12 111.46 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -129.83 146.85 51.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.464 -0.334 . . . . 2.17 111.102 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 53.89 68.79 0.79 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.802 -0.636 . . . . 2.74 111.908 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 170.88 140.31 2.99 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.182 -1.009 . . . . 1.43 113.498 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.04 -158.05 0.08 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 123.367 2.711 . . . . 2.08 112.007 175.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 -146.32 168.2 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.826 -0.435 . . . . 5.35 109.826 178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.487 ' HG3' ' H ' ' A' ' 3' ' ' ALA . 11.8 tpp180 -164.74 177.67 7.81 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.278 -1.008 . . . . 2.94 108.278 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.487 ' H ' ' HG3' ' A' ' 2' ' ' ARG . . . -144.62 165.89 26.75 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.309 -0.626 . . . . 1.09 109.309 171.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.37 43.64 51.95 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 120.584 -0.817 . . . . 0.54 112.401 -174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.88 177.82 4.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.865 0.333 . . . . 0.38 110.635 -175.144 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.4 150.87 51.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.83 0.348 . . . . 0.86 111.259 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 9' ' ' ASN . 43.3 t -85.38 122.52 29.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.21 111.371 -172.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.427 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.49 23.76 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.496 1.118 . . . . 0.31 113.4 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.52 ' H ' ' C ' ' A' ' 7' ' ' CYS . 44.9 t30 -151.2 -49.78 0.12 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 116.532 -0.304 . . . . 0.57 111.416 -178.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.498 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.3 p -121.36 9.18 10.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 119.601 -0.839 . . . . 0.76 111.775 -172.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 47.06 12.41 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.004 1.483 . . . . 1.9 115.004 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -60.87 147.51 42.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.351 -0.843 . . . . 0.33 109.101 170.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 5' ' ' THR . 34.3 p -126.92 9.13 6.86 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.416 -0.811 . . . . 0.42 110.178 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.476 ' O ' HG23 ' A' ' 14' ' ' THR . 14.9 t -107.14 70.09 0.78 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 122.926 1.346 . . . . 1.26 108.965 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.618 HG22 ' H ' ' A' ' 17' ' ' LEU . 7.9 m -143.01 140.58 31.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.528 -1.215 . . . . 0.4 110.12 -174.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -102.52 -8.91 20.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.209 0.528 . . . . 0.54 110.994 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.618 ' H ' HG22 ' A' ' 15' ' ' THR . 12.3 tp -125.55 85.62 2.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.992 0.425 . . . . 0.79 110.627 -173.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -88.77 97.34 11.09 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.993 -0.548 . . . . 0.18 111.584 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.58 173.66 8.52 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.396 -0.82 . . . . 2.03 109.805 176.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 1.8 mmt180 -104.39 149.12 25.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.891 0.376 . . . . 3.9 111.429 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -93.66 -169.3 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.892 -0.781 . . . . 0.2 108.892 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.36 -29.22 47.54 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.881 1.067 . . . . 0.36 113.881 -169.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -107.81 7.39 28.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.776 0.798 . . . . 1.61 109.068 -173.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.56 25.74 27.12 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.1 -0.954 . . . . 0.22 112.624 177.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.52 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -92.55 140.02 23.88 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 1.27 109.693 -178.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 21.1 Cg_endo -64.37 127.69 19.67 Favored 'Trans proline' 0 C--N 1.32 -0.925 0 C-N-CA 123.443 2.762 . . . . 0.21 112.999 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -131.51 147.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.09 -0.708 . . . . 0.12 109.09 177.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.465 ' HA ' HG21 ' A' ' 15' ' ' THR . 3.9 p -68.94 168.68 13.15 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.181 -1.044 . . . . 0.22 108.181 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -53.44 -53.87 45.04 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 119.056 0.844 . . . . 1.52 112.547 -170.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.14 -50.55 61.52 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 118.545 0.612 . . . . 0.21 112.591 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 44' ' ' LEU . 78.9 m -66.16 -37.94 86.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.766 -0.197 . . . . 0.41 111.478 -176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.74 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -77.16 -36.85 33.92 Favored Glycine 0 C--O 1.222 -0.624 0 C-N-CA 120.331 -0.938 . . . . 0.46 112.616 174.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 9.3 tt -65.92 -45.86 80.33 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.983 -0.747 . . . . 0.54 108.983 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.425 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 23.2 t80 -72.32 -40.0 67.78 Favored 'General case' 0 N--CA 1.421 -1.879 0 C-N-CA 119.674 -0.811 . . . . 0.44 110.684 -172.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 87.5 t80 -59.61 -27.5 66.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.83 -0.623 . . . . 0.57 111.272 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.6 mptp? -73.76 -36.04 65.06 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 121.667 0.746 . . . . 1.23 110.419 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -75.59 -41.19 55.24 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.482 -1.235 . . . . 1.19 110.15 -178.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' O ' HG22 ' A' ' 40' ' ' VAL . 65.7 m170 -121.76 -0.2 9.68 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 114.136 1.161 . . . . 1.02 114.136 -162.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 61.51 21.86 12.41 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.687 0.395 . . . . 1.87 111.983 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -145.07 159.57 13.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.67 -0.412 . . . . 0.59 110.643 179.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.59 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 8.4 m-80 -67.29 154.93 40.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.944 -0.571 . . . . 1.73 110.049 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.658 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.0 tmt_? -81.02 110.72 18.89 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 3.32 109.192 -173.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.59 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.7 Cg_exo -54.93 119.06 5.87 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 121.947 1.764 . . . . 0.8 111.07 174.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 7.5 mt -124.81 -143.49 0.31 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.032 -0.531 . . . . 1.8 109.792 -173.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.594 ' HB ' ' OXT' ' A' ' 49' ' ' GLU . 3.5 p -131.86 -138.41 0.2 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.672 -0.862 . . . . 3.21 108.672 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.1 mtm -91.1 -179.62 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 118.066 0.394 . . . . 6.47 110.382 174.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.27 -40.76 82.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.36 -0.607 . . . . 10.6 109.36 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -122.61 71.02 1.01 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.622 -0.717 . . . . 10.22 110.579 173.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.594 ' OXT' ' HB ' ' A' ' 45' ' ' THR . 27.8 mt-10 . . . . . 0 C--O 1.252 1.233 0 CA-C-O 118.705 -0.664 . . . . 7.0 111.491 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 111.529 0.196 . . . . 17.45 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -93.04 25.35 3.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.925 0.343 . . . . 15.75 111.925 -175.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -116.71 27.36 9.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.886 0.374 . . . . 15.5 110.358 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -84.69 143.33 29.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 14.5 110.861 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -159.23 124.84 4.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.779 -0.646 . . . . 12.71 109.874 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -85.28 74.29 10.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.148 -0.478 . . . . 11.69 111.305 -176.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -87.89 136.54 32.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.962 -0.755 . . . . 9.77 108.962 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -78.06 72.52 4.6 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.177 0.513 . . . . 9.59 110.96 -175.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 38.7 m -137.86 40.51 2.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.825 -0.625 . . . . 7.05 110.483 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 32.0 t -127.5 102.33 6.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.989 0.423 . . . . 6.01 111.318 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 76.39 72.29 1.11 Allowed Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.818 -0.628 . . . . 2.88 113.524 173.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.525 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 3.1 mp -122.29 57.7 1.07 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 2.25 110.699 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -149.86 89.36 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.701 -0.681 . . . . 3.44 110.67 172.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.703 ' HB ' HD12 ' A' ' 33' ' ' LEU . 6.2 p -136.17 119.95 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.852 -0.796 . . . . 1.67 108.852 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 3.3 tt -90.31 -50.59 5.89 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.904 0.383 . . . . 3.12 110.852 -172.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.15 136.03 46.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.467 0.543 . . . . 2.17 112.467 -172.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 59.73 71.81 0.56 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 114.906 -1.043 . . . . 2.74 112.99 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.423 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . 165.58 115.87 0.34 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 119.903 -1.141 . . . . 1.43 113.69 177.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -88.91 -151.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.323 2.682 . . . . 2.08 112.64 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 42.7 mtm180 -124.57 -174.06 2.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.332 -0.395 . . . . 5.35 110.053 177.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -169.02 21.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.086 0.47 . . . . 2.94 110.936 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.91 -100.35 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.017 1.117 . . . . 1.09 114.017 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.42 61.95 0.37 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.102 -0.571 . . . . 0.54 113.028 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -100.48 -169.64 1.75 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.202 0.501 . . . . 0.38 110.634 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.693 ' H ' HG22 ' A' ' 5' ' ' THR . 4.3 p -120.22 149.72 41.81 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.736 0.414 . . . . 0.86 111.119 174.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.4 t -80.3 129.07 34.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.271 -0.572 . . . . 0.21 111.092 -176.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 23.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.241 1.016 . . . . 0.31 112.849 174.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.574 ' H ' ' C ' ' A' ' 7' ' ' CYS . 9.8 t30 -155.34 -44.07 0.08 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.93 -0.577 . . . . 0.57 111.157 -176.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' HD23 ' A' ' 44' ' ' LEU . 6.2 m -107.92 -8.87 15.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.293 -0.563 . . . . 0.76 111.953 -175.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.442 ' NE2' ' HA ' ' A' ' 47' ' ' LYS . 1.1 mp0 46.35 15.15 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.772 1.027 . . . . 1.9 113.772 -171.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 t -67.5 150.45 48.84 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 108.911 -0.774 . . . . 0.33 108.911 171.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 5' ' ' THR . 28.9 p -127.79 19.02 6.69 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.211 -0.904 . . . . 0.42 109.434 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -118.0 81.82 1.73 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 122.716 1.246 . . . . 1.26 108.83 173.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 17' ' ' LEU . 38.3 m -150.3 130.69 13.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.064 -0.971 . . . . 0.4 110.669 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.5 m -85.63 -11.67 53.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.176 -0.465 . . . . 0.54 111.66 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.629 ' H ' HG22 ' A' ' 15' ' ' THR . 11.2 tp -129.03 110.57 12.16 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 120.111 -0.636 . . . . 0.79 111.042 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.453 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 88.8 m95 -106.08 94.53 5.22 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.118 0.485 . . . . 0.18 111.2 174.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.509 ' HG3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -86.7 171.2 11.13 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.558 -0.746 . . . . 2.03 109.587 175.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.7 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 4.2 mmt-85 -99.9 148.26 24.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.881 0.372 . . . . 3.9 111.633 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' ASP . 17.0 p30 -93.14 -171.68 2.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.31 -0.852 . . . . 0.2 109.042 171.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.37 29.52 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.99 1.108 . . . . 0.36 113.99 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -100.46 -3.71 30.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 122.096 0.951 . . . . 1.61 108.765 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 89.55 26.76 24.31 Favored Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 114.703 -1.135 . . . . 0.22 111.04 -176.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.7 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 45.5 m-20 -87.37 159.04 51.17 Favored Pre-proline 0 N--CA 1.44 -0.974 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 -177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 54.5 Cg_endo -78.08 130.63 10.41 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 123.049 2.499 . . . . 0.21 112.612 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -137.24 148.84 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.12 110.515 178.329 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.555 ' HA ' HG21 ' A' ' 15' ' ' THR . 10.1 p -72.03 159.77 33.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.643 -1.243 . . . . 0.22 107.643 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' ND2' HG12 ' A' ' -5' ' ' VAL . 0.1 OUTLIER -44.38 -50.72 9.06 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 119.437 1.017 . . . . 1.52 111.508 -173.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -52.26 -43.24 64.28 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 113.416 0.895 . . . . 0.21 113.416 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 74.0 m -79.53 -36.44 38.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.018 0.377 . . . . 0.41 112.018 -174.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.729 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.13 -28.08 67.1 Favored Glycine 0 C--O 1.219 -0.81 0 C-N-CA 119.535 -1.317 . . . . 0.46 111.284 171.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.703 HD12 ' HB ' ' A' ' -5' ' ' VAL . 10.3 tt -72.61 -45.84 57.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.253 -1.017 . . . . 0.54 108.253 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -68.99 -49.16 60.33 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.446 -0.797 . . . . 0.44 111.093 -173.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.68 -25.45 60.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.57 111.383 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 3.0 mptp? -75.33 -37.77 60.57 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.573 0.701 . . . . 1.23 110.304 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.8 mt -74.83 -42.14 58.57 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.827 -1.079 . . . . 1.19 109.911 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -120.86 -3.27 9.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 114.041 1.126 . . . . 1.02 114.041 -162.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.7 m120 59.92 27.37 16.73 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.676 0.621 . . . . 1.87 112.676 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.93 160.83 11.52 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 N-CA-C 109.818 -0.438 . . . . 0.59 109.818 172.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.574 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 17.4 m-80 -70.09 160.74 31.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.281 -0.637 . . . . 1.73 109.281 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 58.3 ttt180 -88.42 110.02 33.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 C-N-CA 120.71 -0.396 . . . . 3.32 110.872 -173.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.5 Cg_exo -55.5 117.76 4.42 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.431 1.421 . . . . 0.8 109.308 172.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.654 HD23 ' SG ' ' A' ' 10' ' ' CYS . 8.2 tp -156.51 -73.54 0.1 Allowed 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.983 -0.553 . . . . 1.8 111.248 -165.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -140.86 -155.55 0.6 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.996 -0.547 . . . . 3.21 109.763 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.465 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 28.6 tpp -136.56 -142.38 0.17 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.113 0.415 . . . . 6.47 109.992 -178.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 46' ' ' MET . 76.7 tttt -83.17 58.03 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.834 0.35 . . . . 10.6 110.397 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 54.54 85.69 0.06 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.576 -0.738 . . . . 10.22 110.913 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.353 -0.832 . . . . 7.0 110.263 -177.933 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.883 -0.043 . . . . 17.45 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . 57.69 84.44 0.1 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.547 0.529 . . . . 15.75 110.452 -176.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 32.7 m80 62.01 -156.05 0.34 Allowed 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.08 -0.711 . . . . 15.5 109.08 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 70.3 m80 61.67 40.69 12.95 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.115 0.484 . . . . 14.5 110.147 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -75.87 97.13 3.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.876 -0.602 . . . . 12.71 111.192 -177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -65.87 115.76 6.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.081 -0.711 . . . . 11.69 109.081 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -65.38 101.15 0.54 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.139 0.495 . . . . 9.77 111.132 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -105.28 136.03 45.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.712 -0.676 . . . . 9.59 110.22 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 8.6 t 65.03 -171.32 0.19 Allowed 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.688 0.617 . . . . 7.05 110.015 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' -6' ' ' GLU . 24.1 m 56.38 55.42 6.61 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.064 0.459 . . . . 6.01 110.674 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -75.73 -11.37 84.57 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 121.009 -0.615 . . . . 2.88 112.997 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . . . . . . . . . 14.9 mt -122.72 78.39 1.53 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.84 -0.43 . . . . 2.25 109.84 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' -9' ' ' SER . 24.6 mt-10 -113.47 -83.6 0.6 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.916 -0.314 . . . . 3.44 111.752 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 33' ' ' LEU . 7.3 p 38.7 56.55 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-O 122.285 1.04 . . . . 1.67 111.89 178.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 46.0 tp -87.07 60.62 6.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.156 -0.929 . . . . 3.12 110.686 -175.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -160.52 33.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.069 -0.514 . . . . 2.17 111.225 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -139.53 -57.35 0.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 2.74 111.384 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 175.57 -178.41 47.16 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.284 -0.96 . . . . 1.43 113.056 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.06 -148.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.383 2.722 . . . . 2.08 112.897 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.424 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 5.0 ptm180 -114.4 -164.6 0.94 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.277 -0.268 . . . . 5.35 110.277 177.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.497 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 65.2 ttt180 -151.12 34.32 0.58 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.491 0.662 . . . . 2.94 110.026 -177.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.79 -104.16 0.14 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.338 0.866 . . . . 1.09 113.338 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.59 52.83 0.77 Allowed Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.967 -0.635 . . . . 0.54 112.905 -172.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 6' ' ' CYS . 1.3 m -80.75 -169.36 2.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.582 0.191 . . . . 0.38 111.09 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.702 ' H ' HG22 ' A' ' 5' ' ' THR . 4.5 p -122.45 147.47 46.29 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 122.587 0.355 . . . . 0.86 111.106 173.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.575 ' C ' ' H ' ' A' ' 9' ' ' ASN . 52.8 t -78.41 128.61 33.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.298 -0.561 . . . . 0.21 111.289 -173.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 24.29 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.096 0.958 . . . . 0.31 112.899 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.575 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.6 t30 -156.57 -44.44 0.07 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.89 -0.595 . . . . 0.57 110.577 -176.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.633 ' SG ' HD23 ' A' ' 44' ' ' LEU . 5.0 m -109.74 -7.2 15.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.423 -0.511 . . . . 0.76 112.188 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 44.67 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.764 1.394 . . . . 1.9 114.764 -173.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 6.6 t -69.03 155.52 40.22 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.821 -0.807 . . . . 0.33 108.821 171.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 5' ' ' THR . 26.6 p -125.35 2.61 7.76 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.771 0.796 . . . . 0.42 109.925 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.74 80.89 2.23 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.651 -1.159 . . . . 1.26 110.059 175.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.623 HG21 ' HA ' ' A' ' 28' ' ' CYS . 87.2 m -150.61 131.99 14.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.4 110.706 -178.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 m -85.04 -16.03 42.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.022 -0.535 . . . . 0.54 111.881 -173.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.654 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.6 tp -131.49 96.34 3.96 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.133 -0.627 . . . . 0.79 111.741 -176.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.497 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 92.8 m95 -91.07 96.09 10.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.094 0.473 . . . . 0.18 111.452 178.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.708 HH11 ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.96 172.31 9.24 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.901 -0.59 . . . . 2.03 110.09 175.33 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.704 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -96.27 149.03 22.12 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.815 0.34 . . . . 3.9 111.513 176.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.422 ' CG ' ' HB2' ' A' ' 25' ' ' ASP . 16.6 p30 -93.47 -169.85 2.23 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 118.448 -0.787 . . . . 0.2 109.06 171.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' A' ' 35' ' ' TYR . . . -52.87 -30.01 31.46 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.859 1.059 . . . . 0.36 113.859 -171.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -105.22 4.6 31.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.828 0.823 . . . . 1.61 108.87 -172.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.532 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 85.81 31.07 21.94 Favored Glycine 0 N--CA 1.433 -1.53 0 CA-C-N 114.74 -1.118 . . . . 0.22 111.677 -178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.704 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 66.8 m-20 -90.22 159.72 41.51 Favored Pre-proline 0 N--CA 1.444 -0.735 0 N-CA-C 109.874 -0.417 . . . . 1.27 109.874 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 43.0 Cg_endo -78.15 131.05 10.59 Favored 'Trans proline' 0 C--N 1.323 -0.803 0 C-N-CA 123.178 2.585 . . . . 0.21 112.607 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -139.0 150.49 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.052 0.453 . . . . 0.12 110.67 179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HA ' HG21 ' A' ' 15' ' ' THR . 7.1 p -71.1 167.33 19.53 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.391 -0.966 . . . . 0.22 108.391 179.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.617 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -51.25 -55.13 19.78 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 119.153 0.888 . . . . 1.52 111.669 -170.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.11 -41.24 64.81 Favored 'General case' 0 C--O 1.217 -0.658 0 N-CA-C 112.134 0.42 . . . . 0.21 112.134 -176.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 99.8 m -70.66 -44.11 67.73 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.099 0.407 . . . . 0.41 112.099 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.585 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.88 -26.84 68.1 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 119.247 -1.454 . . . . 0.46 111.71 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.717 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -74.03 -47.96 33.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.875 -0.787 . . . . 0.54 108.875 177.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.511 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 35.6 t80 -74.89 -42.41 57.88 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.973 -0.558 . . . . 0.44 110.891 -171.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.495 ' OH ' ' HB2' ' A' ' 22' ' ' ALA . 88.5 t80 -59.9 -26.45 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.512 -0.475 . . . . 0.57 111.055 176.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.4 OUTLIER -79.61 -31.0 41.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.639 . . . . 1.23 110.672 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 6.4 mt -79.98 -39.91 29.09 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.079 -0.964 . . . . 1.19 110.29 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.83 -0.52 10.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.649 0.981 . . . . 1.02 113.649 -162.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 60.6 22.1 11.91 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.51 0.559 . . . . 1.87 112.51 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER -142.42 160.44 19.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 C-N-CA 120.08 -0.648 . . . . 0.59 111.212 178.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.62 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.8 m-80 -66.73 159.57 27.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 1.73 109.825 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 0.6 OUTLIER -89.62 107.99 22.26 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.777 -0.453 . . . . 3.32 109.777 -172.601 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.8 Cg_exo -55.09 116.88 3.45 Favored 'Trans proline' 0 CA--C 1.509 -0.733 0 C-N-CA 121.687 1.592 . . . . 0.8 109.303 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.633 HD23 ' SG ' ' A' ' 10' ' ' CYS . 10.6 tp -162.24 -69.85 0.05 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.896 -0.593 . . . . 1.8 111.178 -164.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.9 p -142.33 -156.95 0.73 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.417 -0.81 . . . . 3.21 108.907 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.8 tpt -140.37 155.77 46.65 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 6.47 109.817 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -42.44 -49.11 5.28 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.953 0.783 . . . . 10.6 111.435 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -131.95 72.95 1.51 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.506 -0.316 . . . . 10.22 110.794 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 116.06 -0.518 . . . . 7.0 111.721 173.28 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 46.0 tpp . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.629 0.252 . . . . 17.45 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -70.4 97.2 1.23 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.944 0.402 . . . . 15.75 111.897 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -109.46 -39.25 5.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.179 -0.464 . . . . 15.5 110.587 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -112.94 59.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.355 -0.384 . . . . 14.5 109.992 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 63.3 m80 62.91 -110.34 0.33 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.91 -0.587 . . . . 12.71 110.254 -173.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 64.92 -71.59 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.058 0.543 . . . . 11.69 111.171 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -91.24 126.08 36.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.253 -0.43 . . . . 9.77 109.918 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -82.52 80.62 8.61 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.414 -0.588 . . . . 9.59 109.414 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 5.8 m -78.52 89.9 4.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.602 -0.726 . . . . 7.05 109.903 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 62.9 m -56.44 95.23 0.02 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.609 0.568 . . . . 6.01 111.617 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' -7' ' ' LEU . . . -90.99 68.65 2.24 Favored Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 110.327 -1.109 . . . . 2.88 110.327 174.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' -8' ' ' GLY . 0.3 OUTLIER 78.64 119.49 0.05 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.039 0.923 . . . . 2.25 110.34 -174.23 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.566 ' HG2' ' H ' ' A' ' -5' ' ' VAL . 20.5 tt0 -157.61 -145.19 0.14 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.032 -1.44 . . . . 3.44 107.269 -170.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.682 ' HB ' HD12 ' A' ' 33' ' ' LEU . 4.8 p 50.97 -67.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 C-N-CA 125.152 1.381 . . . . 1.67 114.57 176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . 0.56 ' H ' HG13 ' A' ' -5' ' ' VAL . 55.5 tp 79.24 -60.58 0.35 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.82 1.045 . . . . 3.12 113.82 171.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -51.7 -77.6 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.345 1.239 . . . . 2.17 114.345 -166.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -95.37 83.68 3.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.746 -0.596 . . . . 2.74 111.503 -173.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 150.79 119.01 0.87 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 1.43 112.708 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -85.99 -147.97 0.03 OUTLIER 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.609 2.873 . . . . 2.08 112.447 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.659 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 24.6 ptt180 -134.26 179.21 6.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.797 -0.183 . . . . 5.35 110.911 176.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.473 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 51.7 ttt180 -159.66 31.58 0.19 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.714 0.292 . . . . 2.94 111.483 -172.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.43 -106.99 0.35 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.502 0.927 . . . . 1.09 113.502 175.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.26 79.29 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.389 -0.91 . . . . 0.54 112.309 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.689 ' O ' HG22 ' A' ' 13' ' ' THR . 1.8 m -110.55 -173.21 2.19 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.576 -0.812 . . . . 0.38 109.456 177.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.66 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -119.02 149.96 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.84 0.352 . . . . 0.86 111.106 173.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.6 t -84.07 124.54 31.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.134 -0.484 . . . . 0.21 111.566 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.4 23.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.676 1.19 . . . . 0.31 113.746 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.511 ' H ' ' C ' ' A' ' 7' ' ' CYS . 46.8 t30 -156.21 -46.24 0.08 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.679 -0.237 . . . . 0.57 111.163 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.725 ' HB2' ' OG1' ' A' ' 45' ' ' THR . 14.2 p -122.69 6.89 9.42 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 119.242 -0.983 . . . . 0.76 112.189 -175.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 44.18 20.85 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.757 1.762 . . . . 1.9 115.757 177.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 t -67.65 147.91 52.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.134 -0.691 . . . . 0.33 109.134 166.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.689 HG22 ' O ' ' A' ' 5' ' ' THR . 15.4 p -122.87 5.93 9.36 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.447 -0.797 . . . . 0.42 109.998 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.503 ' O ' HG23 ' A' ' 14' ' ' THR . 14.5 t -102.22 70.93 1.21 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.799 1.285 . . . . 1.26 108.971 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.66 HG22 ' H ' ' A' ' 17' ' ' LEU . 5.8 m -148.25 138.82 22.87 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.823 -1.08 . . . . 0.4 110.568 -176.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 m -99.9 -2.99 33.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 0.54 111.13 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.66 ' H ' HG22 ' A' ' 15' ' ' THR . 24.5 tp -127.54 91.12 3.24 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.933 0.396 . . . . 0.79 110.922 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.659 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 89.4 m95 -95.41 94.85 8.06 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.477 0.656 . . . . 0.18 111.408 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -85.37 172.1 11.33 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.0 -1.0 . . . . 2.03 109.763 175.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.561 ' HA ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -99.9 149.74 23.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.822 0.344 . . . . 3.9 110.953 175.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.06 -168.27 1.6 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.643 -0.708 . . . . 0.2 109.42 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.57 -23.38 26.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.357 0.873 . . . . 0.36 113.357 -173.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -96.8 0.12 48.85 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 108.161 -1.051 . . . . 1.61 108.161 -173.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 72.62 27.81 68.62 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.337 -1.301 . . . . 0.22 109.901 -170.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 28.8 m-20 -93.78 159.12 35.3 Favored Pre-proline 0 N--CA 1.445 -0.683 0 CA-C-O 121.024 0.44 . . . . 1.27 110.066 -178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 25' ' ' ASP . 32.2 Cg_endo -74.9 132.2 15.29 Favored 'Trans proline' 0 C--N 1.324 -0.748 0 C-N-CA 123.436 2.757 . . . . 0.21 113.495 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.4 OUTLIER -139.64 150.17 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 109.52 -0.548 . . . . 0.12 109.52 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.485 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.49 169.32 15.66 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.214 -1.032 . . . . 0.22 108.214 179.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.615 ' HB2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -51.8 -54.75 25.26 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 119.196 0.907 . . . . 1.52 111.767 -175.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -51.73 -48.33 63.68 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 113.038 0.755 . . . . 0.21 113.038 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -71.94 -37.47 70.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.501 0.185 . . . . 0.41 111.501 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.756 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -76.25 -29.49 58.38 Favored Glycine 0 C--O 1.22 -0.724 0 C-N-CA 120.231 -0.985 . . . . 0.46 112.335 174.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.682 HD12 ' HB ' ' A' ' -5' ' ' VAL . 9.9 tt -72.47 -43.47 63.65 Favored 'General case' 0 CA--C 1.501 -0.941 0 N-CA-C 108.523 -0.918 . . . . 0.54 108.523 177.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -68.2 -47.31 68.25 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.692 -0.685 . . . . 0.44 111.265 -173.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -58.06 -27.31 63.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.182 -0.463 . . . . 0.57 110.9 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.756 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 10.1 mptt -72.67 -34.53 67.28 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.642 0.734 . . . . 1.23 109.938 -177.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.1 mt -77.92 -42.6 32.62 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.579 -1.191 . . . . 1.19 110.239 178.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.479 ' O ' HG22 ' A' ' 40' ' ' VAL . 61.7 m170 -121.39 -0.87 9.73 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.591 1.33 . . . . 1.02 114.591 -162.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.87 28.0 14.56 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.093 0.405 . . . . 1.87 112.093 176.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER -153.71 160.96 2.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.2 -0.454 . . . . 0.59 109.882 -178.305 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.605 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 14.4 m-80 -76.24 154.15 35.46 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.646 -0.502 . . . . 1.73 109.646 -178.241 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.441 ' HD3' HD22 ' A' ' 44' ' ' LEU . 49.8 ttt180 -82.02 111.49 27.51 Favored Pre-proline 0 N--CA 1.45 -0.448 0 O-C-N 123.233 0.333 . . . . 3.32 110.738 -171.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.605 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 64.4 Cg_exo -56.79 117.87 4.62 Favored 'Trans proline' 0 CA--C 1.508 -0.786 0 C-N-CA 121.608 1.539 . . . . 0.8 108.809 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD22 ' HD3' ' A' ' 42' ' ' ARG . 11.7 tp -166.13 -74.68 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.689 -0.687 . . . . 1.8 110.551 -164.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 10' ' ' CYS . 16.3 p -150.3 -165.02 2.16 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.118 -1.067 . . . . 3.21 108.118 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' A' ' 9' ' ' ASN . 47.6 ttm -168.97 -75.28 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 118.907 0.776 . . . . 6.47 110.979 -175.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -141.71 46.7 1.67 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.923 -1.035 . . . . 10.6 108.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.4 mttp 53.26 78.15 0.15 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.909 -1.042 . . . . 10.22 110.596 -172.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.521 -0.752 . . . . 7.0 110.409 -174.976 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 121.01 0.433 . . . . 17.45 110.145 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -133.61 -63.36 0.75 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 15.75 109.777 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 19.0 t60 59.52 67.78 0.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 15.5 111.098 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -129.32 20.13 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.602 -0.726 . . . . 14.5 110.092 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 54.0 m170 -102.97 13.42 34.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 12.71 111.098 -176.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -71.08 -47.01 60.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.637 0.256 . . . . 11.69 110.754 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -131.95 -43.16 0.98 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.89 -0.324 . . . . 9.77 111.016 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -60.14 -42.06 94.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.968 0.413 . . . . 9.59 110.798 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 6.1 m -124.38 53.1 1.46 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.135 -0.484 . . . . 7.05 109.943 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 20.8 t -63.0 -47.92 81.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.998 -0.546 . . . . 6.01 110.07 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . 170.87 -70.02 0.13 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.484 -0.865 . . . . 2.88 112.506 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.599 ' H ' HD23 ' A' ' -7' ' ' LEU . 0.4 OUTLIER -95.09 59.64 2.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.312 0.577 . . . . 2.25 110.97 -174.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -86.67 49.99 1.91 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.614 -0.721 . . . . 3.44 111.087 -175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.534 HG23 ' CE1' ' A' ' -3' ' ' PHE . 6.0 p -148.37 122.18 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 1.67 110.782 -177.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 26.4 tp -145.55 57.31 1.24 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.997 0.427 . . . . 3.12 111.05 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.534 ' CE1' HG23 ' A' ' -5' ' ' VAL . 42.5 p90 -145.69 31.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.329 0.492 . . . . 2.17 112.329 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -177.98 61.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.757 0.28 . . . . 2.74 111.757 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 122.83 130.45 3.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.51 -0.852 . . . . 1.43 112.501 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -84.41 -64.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.58 2.186 . . . . 2.08 113.495 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.514 ' HG2' ' H ' ' A' ' 2' ' ' ARG . 68.2 ttt180 -175.49 177.69 1.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.567 -0.901 . . . . 5.35 108.567 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.514 ' H ' ' HG2' ' A' ' 1' ' ' ARG . 23.6 ttt180 -164.22 22.71 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.239 0.543 . . . . 2.94 110.532 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.405 ' H ' ' HG2' ' A' ' 1' ' ' ARG . . . 52.11 -99.39 0.08 Allowed 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.958 1.096 . . . . 1.09 113.958 176.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.14 60.22 0.4 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 121.146 -0.55 . . . . 0.54 112.995 -170.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.784 HG22 ' H ' ' A' ' 6' ' ' CYS . 4.0 m -102.62 -171.13 1.9 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.167 0.483 . . . . 0.38 110.021 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.784 ' H ' HG22 ' A' ' 5' ' ' THR . 2.4 p -121.97 150.78 41.55 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.539 0.336 . . . . 0.86 111.624 177.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.552 ' C ' ' H ' ' A' ' 9' ' ' ASN . 50.0 t -80.0 128.61 33.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 120.28 -0.568 . . . . 0.21 111.554 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.443 ' HB2' ' OD1' ' A' ' 25' ' ' ASP . . . -63.5 24.34 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.317 1.047 . . . . 0.31 112.979 173.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' H ' ' C ' ' A' ' 7' ' ' CYS . 7.3 t30 -156.48 -44.11 0.07 Allowed 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.991 -0.55 . . . . 0.57 110.954 -175.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.625 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.9 m -110.6 -6.76 14.79 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 120.499 -0.48 . . . . 0.76 111.948 -175.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 42.41 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.289 1.218 . . . . 1.9 114.289 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -68.78 154.47 41.92 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.655 -0.869 . . . . 0.33 108.655 170.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' THR . 20.0 p -125.37 6.16 7.7 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.915 0.864 . . . . 0.42 109.633 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.43 76.12 2.26 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.334 -1.303 . . . . 1.26 109.72 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.642 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.4 m -149.4 132.95 16.72 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.232 -0.44 . . . . 0.4 110.558 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -93.18 -10.55 35.39 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.366 -0.379 . . . . 0.54 111.353 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' H ' HG22 ' A' ' 15' ' ' THR . 16.0 tp -130.17 89.17 2.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.918 0.389 . . . . 0.79 111.427 -175.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -88.75 97.84 11.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.002 -0.545 . . . . 0.18 111.577 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.89 172.78 8.64 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.552 -0.749 . . . . 2.03 110.083 174.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -102.2 150.36 23.36 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.192 0.52 . . . . 3.9 111.307 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -100.7 -169.45 1.71 Allowed 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.56 -0.746 . . . . 0.2 109.212 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.9 55.99 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.844 1.053 . . . . 0.36 113.844 -170.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -104.21 4.55 34.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.45 1.119 . . . . 1.61 108.179 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.45 32.73 15.36 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 113.751 -1.568 . . . . 0.22 112.262 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.585 ' CG ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -88.87 142.63 30.63 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 108.968 -0.753 . . . . 1.27 108.968 178.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HD2' ' CG ' ' A' ' 25' ' ' ASP . 19.2 Cg_endo -62.57 131.44 33.67 Favored 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 124.077 3.185 . . . . 0.21 112.371 -176.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.535 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -138.01 146.83 26.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.651 -0.42 . . . . 0.12 110.521 -178.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.642 ' HA ' HG21 ' A' ' 15' ' ' THR . 5.2 p -69.27 164.37 22.94 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 107.808 -1.182 . . . . 0.22 107.808 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.503 ' ND2' ' HA ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -55.36 -50.2 70.3 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 119.279 0.945 . . . . 1.52 111.668 -168.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.5 36.89 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.477 0.485 . . . . 0.21 112.214 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 42' ' ' ARG . 93.4 m -80.36 -44.57 19.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.335 0.494 . . . . 0.41 112.335 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.646 ' O ' ' HE3' ' A' ' 36' ' ' LYS . . . -73.74 -23.06 77.51 Favored Glycine 0 C--O 1.216 -1.027 0 C-N-CA 119.244 -1.455 . . . . 0.46 111.333 174.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -73.97 -48.43 30.48 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.189 -1.041 . . . . 0.54 108.189 173.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.596 ' HE1' HG23 ' A' ' 40' ' ' VAL . 47.8 t80 -75.39 -43.68 48.9 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 120.168 -0.613 . . . . 0.44 112.26 -170.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -62.02 -27.78 69.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.277 -0.569 . . . . 0.57 110.223 177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.761 ' HE2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -68.84 -34.79 76.06 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.336 0.589 . . . . 1.23 109.99 -179.097 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 4.4 mt -81.27 -41.35 22.32 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.047 -0.979 . . . . 1.19 110.322 -178.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 64.7 m170 -120.94 -0.36 10.09 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.875 1.065 . . . . 1.02 113.875 -162.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.17 28.69 18.29 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.91 0.337 . . . . 1.87 111.91 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.596 HG23 ' HE1' ' A' ' 34' ' ' TYR . 1.2 m -150.22 162.86 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.259 -0.428 . . . . 0.59 110.654 -178.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.603 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.4 p30 -67.65 166.24 15.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.798 -0.637 . . . . 1.73 110.624 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.0 tpt180 -95.44 106.89 29.42 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.716 -0.674 . . . . 3.32 110.117 -174.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.603 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 51.7 Cg_exo -57.5 117.23 3.89 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 121.574 1.516 . . . . 0.8 108.737 170.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.625 HD23 ' SG ' ' A' ' 10' ' ' CYS . 11.9 tp -159.28 -73.62 0.08 Allowed 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.823 -0.626 . . . . 1.8 111.88 -162.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.447 ' HB ' ' H ' ' A' ' 46' ' ' MET . 17.1 p -140.69 -152.07 0.39 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.74 -0.664 . . . . 3.21 109.902 -176.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.447 ' H ' ' HB ' ' A' ' 45' ' ' THR . 43.3 tpp -142.86 168.18 20.33 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.53 -0.544 . . . . 6.47 109.53 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -44.49 -53.47 6.95 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.768 0.668 . . . . 10.6 111.387 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -132.78 84.07 2.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.359 -0.608 . . . . 10.22 109.359 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.441 -0.79 . . . . 7.0 109.468 179.25 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 60.7 ttp . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.845 0.355 . . . . 17.45 110.386 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . 0.502 ' HB3' ' HB3' ' A' ' -14' ' ' HIS . . . -136.67 109.61 7.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.104 -0.498 . . . . 15.75 110.136 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -67.57 -25.74 65.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 15.5 111.309 -176.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.26 63.96 1.16 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.351 -0.611 . . . . 14.5 109.351 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . 0.502 ' HB3' ' HB3' ' A' ' -17' ' ' ALA . 19.7 p-80 -86.79 139.98 30.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.786 -0.643 . . . . 12.71 110.703 -178.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -176.11 -37.78 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.826 -0.625 . . . . 11.69 109.332 -177.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 67.91 -76.3 0.06 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 114.964 -1.016 . . . . 9.77 111.364 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -149.91 -59.79 0.2 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.577 -0.527 . . . . 9.59 109.577 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 25.3 m 64.27 98.36 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.783 0.677 . . . . 7.05 112.207 175.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . 0.426 ' HA ' ' OE2' ' A' ' -6' ' ' GLU . 67.7 m -147.37 79.02 1.49 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.559 -0.746 . . . . 6.01 109.682 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.12 -126.79 4.29 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.918 -0.658 . . . . 2.88 112.296 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.584 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -86.37 72.62 10.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.703 0.763 . . . . 2.25 111.464 -177.448 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.426 ' OE2' ' HA ' ' A' ' -9' ' ' SER . 36.4 mt-10 -104.73 29.95 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 3.44 111.774 -175.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.474 HG12 HD21 ' A' ' 29' ' ' ASN . 4.3 p -127.81 127.68 68.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.905 -0.406 . . . . 1.67 109.905 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 1.9 pp -115.28 19.66 15.42 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.409 0.522 . . . . 3.12 112.409 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.427 ' O ' ' HB2' ' A' ' -2' ' ' GLN . 17.2 p90 -134.69 106.32 6.89 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.62 -0.432 . . . . 2.17 111.727 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.506 ' OE1' ' HB2' ' A' ' 20' ' ' ARG . 7.1 tp-100 158.57 -74.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.663 1.185 . . . . 2.74 110.51 170.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -137.34 160.21 25.0 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.545 -0.836 . . . . 1.43 112.625 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -84.72 -67.31 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.352 2.701 . . . . 2.08 113.47 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -172.33 -178.71 2.09 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.296 0.238 . . . . 5.35 110.494 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -161.89 -12.18 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.696 -0.229 . . . . 2.94 111.051 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.03 -100.53 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.235 0.828 . . . . 1.09 113.235 171.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.23 57.46 2.06 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.363 -0.446 . . . . 0.54 112.762 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.546 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -112.9 -176.5 2.91 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.279 -0.541 . . . . 0.38 110.637 -176.569 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.546 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -125.48 151.49 46.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.926 0.393 . . . . 0.86 111.416 177.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 9' ' ' ASN . 37.2 t -82.15 122.43 27.86 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.887 -0.597 . . . . 0.21 111.283 -174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.33 24.54 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.704 1.201 . . . . 0.31 113.364 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.504 ' H ' ' C ' ' A' ' 7' ' ' CYS . 10.6 t30 -156.93 -44.81 0.07 Allowed 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.752 -0.379 . . . . 0.57 111.693 -173.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.37 11.55 6.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 119.238 -0.985 . . . . 0.76 111.808 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 39.89 24.6 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 116.362 1.986 . . . . 1.9 116.362 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -68.5 153.11 44.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.671 -0.862 . . . . 0.33 108.671 164.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 5' ' ' THR . 21.1 p -127.49 5.88 6.26 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.54 -0.755 . . . . 0.42 110.271 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.517 ' O ' HG23 ' A' ' 14' ' ' THR . 14.6 t -102.74 74.48 1.35 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.649 1.214 . . . . 1.26 109.33 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.629 HG21 ' HA ' ' A' ' 28' ' ' CYS . 26.2 m -146.85 134.44 20.98 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.106 -0.952 . . . . 0.4 110.506 -175.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.6 m -96.67 -11.31 25.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 0.54 111.529 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.735 HD23 ' OD1' ' A' ' 29' ' ' ASN . 14.3 tp -129.42 77.59 1.8 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.514 0.673 . . . . 0.79 110.527 -171.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -77.22 97.77 4.91 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.99 -1.005 . . . . 0.18 111.402 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD3' ' HA3' ' A' ' 32' ' ' GLY . 0.0 OUTLIER -84.43 173.16 11.11 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 115.746 -0.661 . . . . 2.03 110.319 173.467 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 2.2 mmt180 -101.56 150.22 23.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.751 0.31 . . . . 3.9 110.776 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -96.7 -169.27 1.86 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 118.492 -0.766 . . . . 0.2 109.035 170.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.11 -24.08 24.0 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.117 0.784 . . . . 0.36 113.117 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -93.58 -8.06 42.3 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.591 -0.892 . . . . 1.61 108.591 -173.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.65 23.03 54.72 Favored Glycine 0 N--CA 1.43 -1.73 0 N-CA-C 109.964 -1.254 . . . . 0.22 109.964 -170.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.651 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -92.09 143.17 27.18 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.341 -0.615 . . . . 1.27 109.341 -174.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.651 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 19.0 Cg_endo -62.49 130.71 30.95 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 C-N-CA 123.829 3.019 . . . . 0.21 112.941 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.86 148.9 25.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.268 -0.641 . . . . 0.12 109.268 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' HG21 ' A' ' 15' ' ' THR . 1.7 p -71.46 169.29 15.69 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 107.448 -1.316 . . . . 0.22 107.448 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.735 ' OD1' HD23 ' A' ' 17' ' ' LEU . 3.2 t30 -56.52 -53.85 52.69 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.603 0.964 . . . . 1.52 113.603 -164.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.28 -47.21 69.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.917 0.78 . . . . 0.21 112.258 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 80.3 m -64.77 -33.51 76.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.129 -0.487 . . . . 0.41 111.604 -175.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 19' ' ' ARG . . . -82.14 -43.41 8.13 Favored Glycine 0 C--O 1.22 -0.735 0 C-N-CA 119.877 -1.154 . . . . 0.46 112.184 172.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.6 tt -56.28 -46.55 79.69 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.233 -0.655 . . . . 0.54 109.233 -177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.561 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 34.7 t80 -72.55 -42.23 64.91 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-N 116.019 -0.537 . . . . 0.44 111.448 -171.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.06 -25.8 67.89 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.673 -0.411 . . . . 0.57 110.651 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.1 OUTLIER -73.96 -33.77 64.02 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.48 0.657 . . . . 1.23 110.159 -177.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.6 mt -80.44 -41.14 24.99 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.806 -1.088 . . . . 1.19 110.233 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.467 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.7 m170 -121.34 0.36 10.02 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.077 1.14 . . . . 1.02 114.077 -162.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 52.41 36.2 19.42 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.25 0.833 . . . . 1.87 113.25 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.51 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -150.61 162.77 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 CA-C-N 116.342 -0.39 . . . . 0.59 110.098 175.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.593 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 0.9 OUTLIER -66.56 160.94 24.16 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.589 -0.732 . . . . 1.73 109.763 -178.355 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.704 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.5 tmt_? -94.77 108.25 36.29 Favored Pre-proline 0 C--N 1.313 -1.004 0 N-CA-C 109.37 -0.604 . . . . 3.32 109.37 -169.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.593 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 75.9 Cg_exo -55.12 119.75 7.04 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.026 1.817 . . . . 0.8 110.841 173.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 9.2 mt -124.45 -147.29 0.37 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.811 -0.631 . . . . 1.8 110.138 -172.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.408 ' HB ' ' H ' ' A' ' 46' ' ' MET . 13.3 p -135.37 -149.03 0.32 Allowed 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.861 -0.792 . . . . 3.21 108.861 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.408 ' H ' ' HB ' ' A' ' 45' ' ' THR . 63.2 mmm -102.25 -158.59 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.103 -0.702 . . . . 6.47 109.103 176.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -88.7 80.28 7.29 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.226 0.536 . . . . 10.6 110.636 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 tttm 55.5 86.4 0.06 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 114.532 -1.213 . . . . 10.22 112.329 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.911 -0.566 . . . . 7.0 109.651 174.657 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.091 -0.337 . . . . 17.45 110.091 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -106.82 52.15 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.167 0.508 . . . . 15.75 110.469 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . 0.63 ' HB3' ' O ' ' A' ' -12' ' ' HIS . 33.3 m80 -98.13 -74.12 0.59 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.815 -0.63 . . . . 15.5 109.609 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 52.0 m80 64.76 168.23 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.734 0.646 . . . . 14.5 111.567 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 32.0 t60 59.39 56.9 3.56 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.025 -0.534 . . . . 12.71 110.375 178.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 34.8 t60 70.83 -69.71 0.17 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.355 -0.839 . . . . 11.69 110.633 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . 0.63 ' O ' ' HB3' ' A' ' -16' ' ' HIS . 10.5 t60 -126.15 -50.45 1.55 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.458 -0.942 . . . . 9.77 108.458 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -178.23 -62.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.213 -0.903 . . . . 9.59 108.945 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 57.6 m -157.9 92.91 1.22 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.522 -0.763 . . . . 7.05 109.198 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 25.1 m 66.07 88.49 0.11 Allowed 'General case' 0 CA--C 1.53 0.186 0 O-C-N 123.69 0.619 . . . . 6.01 110.231 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -102.36 -149.25 21.75 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.668 -0.777 . . . . 2.88 111.733 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.624 ' HA ' ' CG ' ' A' ' 29' ' ' ASN . 4.2 mp -81.9 56.35 3.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.5 0.667 . . . . 2.25 109.717 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -114.08 62.97 0.66 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.354 -0.839 . . . . 3.44 111.331 -173.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.48 ' HB ' HD12 ' A' ' 33' ' ' LEU . 2.5 p -142.18 100.02 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.433 0.635 . . . . 1.67 110.555 178.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 32.4 tp -136.27 55.99 1.83 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.99 -0.55 . . . . 3.12 110.405 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.44 ' CE1' HG23 ' A' ' -5' ' ' VAL . 32.8 p90 -131.21 6.11 4.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.362 -0.381 . . . . 2.17 111.565 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 177.51 82.59 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.427 -0.351 . . . . 2.74 110.475 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . 149.77 156.94 7.46 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.294 -0.955 . . . . 1.43 113.57 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -96.48 -159.16 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.964 3.11 . . . . 2.08 112.6 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -146.6 -178.66 6.29 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.3 -0.409 . . . . 5.35 110.668 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.494 ' O ' ' HD1' ' A' ' 18' ' ' TRP . 64.5 ttt-85 -166.32 -178.81 4.7 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.914 -1.143 . . . . 2.94 107.914 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.486 ' H ' ' HG2' ' A' ' 2' ' ' ARG . . . -118.04 -78.12 0.58 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.624 1.102 . . . . 1.09 112.587 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.8 65.34 4.14 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.234 -0.508 . . . . 0.54 112.729 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.529 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -121.0 177.96 4.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.723 0.761 . . . . 0.38 111.15 -176.042 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.09 150.37 52.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.609 -0.515 . . . . 0.86 109.609 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 9' ' ' ASN . 53.9 t -81.69 126.4 31.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 120.444 -0.502 . . . . 0.21 111.933 -171.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.06 24.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.383 1.073 . . . . 0.31 112.865 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.557 ' H ' ' C ' ' A' ' 7' ' ' CYS . 6.5 t30 -157.64 -44.48 0.07 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.37 -0.377 . . . . 0.57 111.445 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -110.24 -4.92 15.44 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.295 -0.562 . . . . 0.76 111.788 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 41.5 17.51 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 114.56 1.318 . . . . 1.9 114.56 -172.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.8 t -68.76 150.82 47.43 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.988 -1.116 . . . . 0.33 107.988 168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 5' ' ' THR . 33.4 p -124.09 4.51 8.6 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.956 0.884 . . . . 0.42 109.116 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.84 72.33 4.16 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.088 -1.414 . . . . 1.26 109.696 174.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 17' ' ' LEU . 53.1 m -151.49 132.83 14.57 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.64 -0.709 . . . . 0.4 109.617 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -97.11 -7.29 33.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.446 . . . . 0.54 111.919 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.55 ' H ' HG22 ' A' ' 15' ' ' THR . 16.8 tp -126.72 88.03 2.76 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.996 0.427 . . . . 0.79 110.638 -175.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.2 m95 -91.34 97.59 11.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.919 -0.582 . . . . 0.18 111.702 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.467 ' HB3' ' NH1' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -88.19 171.9 9.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.791 -0.64 . . . . 2.03 109.63 173.746 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.53 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -105.29 149.01 26.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.716 0.294 . . . . 3.9 111.558 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 p30 -93.67 -168.3 1.87 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.663 -0.684 . . . . 0.2 109.754 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.03 -24.26 16.4 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.667 0.988 . . . . 0.36 113.667 -173.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -103.62 -3.8 24.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.583 0.706 . . . . 1.61 109.523 -173.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 88.98 23.41 35.33 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.592 -1.003 . . . . 0.22 110.592 -171.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.93 134.77 29.65 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 1.27 109.011 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.35 132.07 32.36 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.831 2.354 . . . . 0.21 112.879 -174.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.638 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -133.4 150.78 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.847 -0.615 . . . . 0.12 110.085 -179.179 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HA ' HG21 ' A' ' 15' ' ' THR . 11.1 p -68.73 163.45 23.96 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.525 -1.287 . . . . 0.22 107.525 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.624 ' CG ' ' HA ' ' A' ' -7' ' ' LEU . 0.0 OUTLIER -56.35 -46.4 80.01 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 119.363 0.983 . . . . 1.52 111.32 -168.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.27 -46.63 36.06 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.475 0.484 . . . . 0.21 111.775 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.641 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 92.1 m -69.22 -46.0 68.45 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.387 0.514 . . . . 0.41 112.387 -176.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.793 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -68.84 -39.36 85.63 Favored Glycine 0 C--O 1.22 -0.734 0 C-N-CA 119.141 -1.504 . . . . 0.46 110.944 176.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.664 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 7.8 tt -64.65 -47.05 79.89 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 109.229 -0.656 . . . . 0.54 109.229 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.629 ' CB ' ' HG2' ' A' ' 42' ' ' ARG . 37.4 t80 -74.95 -41.71 59.09 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.137 -0.625 . . . . 0.44 110.941 -172.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -60.48 -25.69 66.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.241 -0.584 . . . . 0.57 110.773 174.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.793 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -70.28 -45.18 66.87 Favored 'General case' 0 CA--C 1.505 -0.75 0 C-N-CA 119.656 -0.818 . . . . 1.23 109.664 178.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 3.7 mt -69.87 -42.59 73.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.838 -1.074 . . . . 1.19 109.97 -177.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 40' ' ' VAL . 67.1 m170 -121.24 -2.98 9.51 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.058 1.133 . . . . 1.02 114.058 -162.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.0 m120 58.33 34.26 23.88 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 112.945 0.72 . . . . 1.87 112.945 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER -149.95 163.53 3.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 120.811 0.338 . . . . 0.59 110.782 177.64 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.571 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 7.8 m-80 -63.9 160.43 17.65 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.282 -0.872 . . . . 1.73 109.8 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.641 ' HB2' ' HA ' ' A' ' 31' ' ' CYS . 1.4 tmt_? -96.77 109.23 47.6 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 116.205 -0.452 . . . . 3.32 110.543 -168.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.2 Cg_exo -59.48 145.36 98.2 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 121.925 1.75 . . . . 0.8 110.4 171.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.54 HD11 ' ND2' ' A' ' 9' ' ' ASN . 0.9 OUTLIER -142.37 -90.94 0.13 Allowed 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.483 -0.487 . . . . 1.8 110.852 -169.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 46' ' ' MET . 6.1 p -163.09 -155.52 0.34 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.922 -1.14 . . . . 3.21 107.922 -177.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.431 ' H ' ' HB ' ' A' ' 45' ' ' THR . 75.8 mmm -105.91 65.46 0.7 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.618 -0.882 . . . . 6.47 108.618 172.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 65.31 31.91 10.22 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 114.987 -1.006 . . . . 10.6 111.132 -176.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 tttm 53.99 84.96 0.06 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.754 -1.112 . . . . 10.22 112.832 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 C--O 1.25 1.089 0 CA-C-N 115.871 -0.604 . . . . 7.0 111.252 174.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.34 -0.245 . . . . 17.45 110.34 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -74.57 -26.77 60.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.418 0.628 . . . . 15.75 110.268 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -118.25 93.18 4.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.397 -0.819 . . . . 15.5 109.741 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -134.36 96.82 3.67 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.692 -0.685 . . . . 14.5 110.38 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -64.33 154.58 34.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 12.71 111.165 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 35.1 m170 60.12 81.66 0.17 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.773 -0.649 . . . . 11.69 111.866 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -134.56 40.21 2.99 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 9.77 110.572 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . 0.487 ' HA ' ' CD ' ' A' ' -6' ' ' GLU . 28.8 m80 59.95 63.66 1.41 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.342 -0.844 . . . . 9.59 110.066 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 13.2 m -93.81 -69.64 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.587 -0.733 . . . . 7.05 111.857 -173.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 12.8 p -148.77 24.56 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.713 0.292 . . . . 6.01 111.549 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -93.61 -159.39 34.48 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.432 -0.889 . . . . 2.88 111.715 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.447 HD22 ' N ' ' A' ' -7' ' ' LEU . 1.1 mm? -89.68 70.7 7.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.124 -1.065 . . . . 2.25 108.124 175.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.487 ' CD ' ' HA ' ' A' ' -11' ' ' HIS . 31.4 mt-10 -126.02 67.33 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 3.44 111.944 -168.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.782 ' HB ' HD12 ' A' ' 33' ' ' LEU . 4.8 p -111.79 106.34 20.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 1.67 108.897 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -93.32 46.0 1.19 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.259 0.466 . . . . 3.12 112.259 -169.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.537 ' O ' ' HB3' ' A' ' -2' ' ' GLN . 5.0 p90 -176.43 175.8 1.72 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.474 -0.33 . . . . 2.17 110.735 177.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.537 ' HB3' ' O ' ' A' ' -3' ' ' PHE . 5.7 tp60 91.65 -73.56 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.005 1.322 . . . . 2.74 112.07 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -168.32 -166.59 27.64 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 119.262 -1.447 . . . . 1.43 114.116 -175.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . 0.419 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 52.3 Cg_endo -94.02 -141.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.858 3.038 . . . . 2.08 112.837 -176.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HA ' ' H ' ' A' ' 18' ' ' TRP . 15.2 ptp180 -116.19 -169.39 1.6 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.476 -0.329 . . . . 5.35 110.217 177.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.449 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 17.5 ttm180 -151.71 16.55 0.69 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.522 0.677 . . . . 2.94 109.98 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.6 -100.93 0.08 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.563 0.949 . . . . 1.09 113.563 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.34 65.51 0.25 Allowed Glycine 0 CA--C 1.523 0.587 0 C-N-CA 121.305 -0.474 . . . . 0.54 112.854 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.635 ' O ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -109.85 -171.83 1.92 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.38 110.733 -178.213 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 5' ' ' THR . 9.3 p -125.02 150.09 47.1 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.451 0.3 . . . . 0.86 110.904 173.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.561 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.1 t -79.25 129.64 34.66 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.319 -0.553 . . . . 0.21 111.449 -174.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.26 25.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.196 0.998 . . . . 0.31 112.596 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 7' ' ' CYS . 11.2 t30 -156.11 -43.06 0.08 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.943 -0.571 . . . . 0.57 111.069 -178.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.714 ' SG ' HD23 ' A' ' 44' ' ' LEU . 4.4 m -113.08 -7.41 13.66 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.687 0.625 . . . . 0.76 112.687 -174.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 42.05 18.76 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.373 1.249 . . . . 1.9 114.373 -168.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.1 t -65.48 150.71 47.9 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.054 -0.721 . . . . 0.33 109.054 170.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 5' ' ' THR . 41.7 p -129.59 19.73 5.67 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.478 -0.783 . . . . 0.42 109.681 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' THR . 12.9 t -114.2 61.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.58 1.181 . . . . 1.26 109.261 176.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 28' ' ' CYS . 24.2 m -138.55 129.41 26.64 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.688 -1.142 . . . . 0.4 110.242 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -10.94 38.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.167 -172.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.732 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 11.5 tp -132.08 87.83 2.48 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 120.391 -0.524 . . . . 0.79 111.14 -173.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.449 ' HD1' ' H ' ' A' ' 2' ' ' ARG . 91.6 m95 -87.8 97.77 11.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.761 -0.654 . . . . 0.18 112.038 -177.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.732 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -84.31 170.8 13.28 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.103 -0.498 . . . . 2.03 110.313 172.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HG2' ' NE2' ' A' ' -2' ' ' GLN . 5.4 ptt180 -105.04 152.1 23.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.949 0.404 . . . . 3.9 110.151 176.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -101.5 -170.48 1.84 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 118.414 -0.803 . . . . 0.2 109.324 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.29 -33.35 63.18 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.661 0.986 . . . . 0.36 113.661 -171.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -93.91 -6.78 44.82 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 122.638 1.208 . . . . 1.61 107.889 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.82 30.94 11.84 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-N 113.286 -1.779 . . . . 0.22 110.975 -177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.72 136.3 28.06 Favored Pre-proline 0 C--N 1.318 -0.795 0 N-CA-C 108.88 -0.785 . . . . 1.27 108.88 -179.018 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.427 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.7 Cg_endo -61.33 134.71 53.43 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.747 2.965 . . . . 0.21 112.803 -175.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.544 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -138.24 149.26 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-O 121.183 0.516 . . . . 0.12 110.938 -178.113 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.567 ' HA ' HG21 ' A' ' 15' ' ' THR . 6.1 p -70.3 165.24 22.7 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 107.722 -1.214 . . . . 0.22 107.722 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -51.71 -54.68 25.69 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.382 0.992 . . . . 1.52 111.349 -170.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' TYR . . . -50.3 -43.21 53.5 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 111.728 0.27 . . . . 0.21 111.728 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.544 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 100.0 m -70.71 -43.04 69.77 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.659 0.614 . . . . 0.41 112.659 -176.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.67 -30.78 61.39 Favored Glycine 0 C--O 1.219 -0.818 0 C-N-CA 119.435 -1.364 . . . . 0.46 111.188 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.782 HD12 ' HB ' ' A' ' -5' ' ' VAL . 6.6 tt -70.83 -41.58 71.34 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.813 -0.81 . . . . 0.54 108.813 174.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.543 ' CD2' ' HD3' ' A' ' 42' ' ' ARG . 56.8 t80 -71.97 -51.07 23.74 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.695 -0.684 . . . . 0.44 111.503 -172.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.62 -25.5 66.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.222 -0.445 . . . . 0.57 110.851 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 0.3 OUTLIER -79.1 -21.68 46.32 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 122.283 1.039 . . . . 1.23 110.013 -177.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mp -92.86 -39.33 11.25 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.336 -1.756 . . . . 1.19 110.165 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -121.23 -4.79 9.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.405 1.261 . . . . 1.02 114.405 -165.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.2 m120 66.46 19.09 10.92 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.681 0.393 . . . . 1.87 111.351 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.41 160.92 17.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 C-N-CA 120.516 -0.474 . . . . 0.59 110.232 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.61 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 29.5 m-80 -69.49 164.19 23.67 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 123.5 0.5 . . . . 1.73 109.809 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.543 ' HD3' ' CD2' ' A' ' 34' ' ' TYR . 28.8 tpt180 -88.3 110.01 32.91 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 3.32 110.83 -173.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.61 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 74.4 Cg_exo -55.82 117.52 4.16 Favored 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 121.681 1.587 . . . . 0.8 109.466 169.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.714 HD23 ' SG ' ' A' ' 10' ' ' CYS . 6.1 tp -159.49 -69.73 0.08 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.49 -0.777 . . . . 1.8 110.795 -165.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.04 -105.29 0.17 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.601 -0.727 . . . . 3.21 110.966 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.517 ' HG2' ' H ' ' A' ' 47' ' ' LYS . 12.9 ttt -124.74 -173.72 2.86 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.267 -0.642 . . . . 6.47 109.267 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.517 ' H ' ' HG2' ' A' ' 46' ' ' MET . 57.2 mtpt -73.95 67.69 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.085 0.469 . . . . 10.6 110.469 176.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' CD ' ' HA ' ' A' ' 9' ' ' ASN . 30.2 mmtp 57.95 82.38 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.081 -0.963 . . . . 10.22 111.554 -177.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.413 -0.804 . . . . 7.0 109.331 179.271 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.808 0.337 . . . . 17.45 110.288 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -117.34 96.08 5.26 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.095 0.474 . . . . 15.75 110.044 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -81.82 -29.98 32.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.744 -0.662 . . . . 15.5 110.368 -176.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 37.4 t-80 -91.56 -51.22 5.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.9 -0.591 . . . . 14.5 110.134 -177.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -79.7 108.58 13.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 12.71 110.529 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -92.58 2.27 56.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.296 0.569 . . . . 11.69 110.444 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -123.13 40.19 3.77 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.492 -0.776 . . . . 9.77 109.698 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -97.28 -72.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 9.59 110.705 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . 0.61 ' HA ' ' CG ' ' A' ' -6' ' ' GLU . 65.1 m -93.44 3.83 54.95 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.404 0.621 . . . . 7.05 110.963 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 6.9 p -95.96 19.18 11.92 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.595 -0.73 . . . . 6.01 110.58 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -149.38 -109.17 0.49 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.324 -0.941 . . . . 2.88 113.63 -176.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.594 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.8 OUTLIER -82.97 53.51 2.45 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.611 0.967 . . . . 2.25 113.611 -168.409 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . 0.61 ' CG ' ' HA ' ' A' ' -10' ' ' SER . 7.0 mm-40 -90.17 50.78 1.91 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 3.44 111.424 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.485 ' HB ' HD12 ' A' ' 33' ' ' LEU . 14.0 p -139.46 34.59 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.926 0.87 . . . . 1.67 109.154 177.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 37.8 tp -76.17 57.34 1.11 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.577 -0.738 . . . . 3.12 111.116 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.501 ' CD2' ' HG2' ' A' ' -2' ' ' GLN . 15.3 p90 -156.79 14.74 0.28 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.711 -0.677 . . . . 2.17 110.548 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.501 ' HG2' ' CD2' ' A' ' -3' ' ' PHE . 82.4 mm-40 -143.7 33.7 1.28 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.257 -0.429 . . . . 2.74 111.349 -175.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.425 ' HA2' ' HD3' ' A' ' 0' ' ' PRO . . . 134.09 155.41 7.57 Favored Glycine 0 CA--C 1.524 0.622 0 C-N-CA 120.262 -0.971 . . . . 1.43 113.674 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 1' ' ' ARG . 6.2 Cg_endo -90.21 -144.25 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.979 3.119 . . . . 2.08 112.632 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.428 ' H ' ' HB2' ' A' ' 0' ' ' PRO . 16.8 ptp180 -121.72 -163.71 1.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.598 -0.274 . . . . 5.35 110.432 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' H ' ' HD1' ' A' ' 18' ' ' TRP . 18.0 ttm180 -158.63 1.42 0.1 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.745 0.307 . . . . 2.94 111.029 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.4 -94.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.618 0.969 . . . . 1.09 113.618 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.11 60.95 0.32 Allowed Glycine 0 CA--C 1.52 0.352 0 C-N-CA 121.167 -0.539 . . . . 0.54 113.17 -170.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.637 HG22 ' H ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -111.08 -171.8 1.9 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.078 0.439 . . . . 0.38 110.164 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.637 ' H ' HG22 ' A' ' 5' ' ' THR . 3.8 m -126.5 150.94 48.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.809 -0.441 . . . . 0.86 109.809 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' ASN . 51.4 t -81.42 128.95 34.42 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 120.365 -0.534 . . . . 0.21 111.635 -174.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 24.2 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.585 1.154 . . . . 0.31 113.028 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 7' ' ' CYS . 8.2 t30 -159.6 -42.39 0.05 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.273 -0.421 . . . . 0.57 111.501 -175.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.69 ' SG ' HD23 ' A' ' 44' ' ' LEU . 3.7 m -114.38 -2.81 13.16 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 120.394 -0.522 . . . . 0.76 112.058 -176.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 43.04 13.68 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.193 1.553 . . . . 1.9 115.193 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.421 ' O ' ' HH2' ' A' ' 18' ' ' TRP . 6.6 t -64.85 148.01 52.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.57 -0.9 . . . . 0.33 108.57 169.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 5' ' ' THR . 35.6 p -126.79 23.44 6.68 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.95 0.881 . . . . 0.42 109.417 -178.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 14' ' ' THR . 13.6 t -131.56 65.79 1.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.522 -1.217 . . . . 1.26 111.029 -178.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.801 HG21 ' HA ' ' A' ' 28' ' ' CYS . 11.3 t -136.68 143.05 43.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.631 -0.713 . . . . 0.4 109.361 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 m -83.93 -10.15 58.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.319 -0.401 . . . . 0.54 112.076 -173.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 3.3 tp -133.78 88.84 2.51 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.806 -0.758 . . . . 0.79 111.873 -172.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.421 ' HH2' ' O ' ' A' ' 12' ' ' THR . 91.7 m95 -85.04 97.22 9.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.746 0.307 . . . . 0.18 111.72 177.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.806 ' NH1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -86.44 173.04 9.91 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.212 -0.449 . . . . 2.03 109.816 171.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -108.34 150.26 27.57 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.109 0.48 . . . . 3.9 110.914 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -98.55 -169.27 1.77 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.734 -0.666 . . . . 0.2 109.681 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.59 -37.2 62.75 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 113.706 1.002 . . . . 0.36 113.706 -169.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -97.55 -6.24 33.98 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 122.418 1.104 . . . . 1.61 108.166 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.6 32.25 6.37 Favored Glycine 0 N--CA 1.434 -1.466 0 CA-C-N 113.64 -1.618 . . . . 0.22 112.105 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.618 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -90.2 142.61 28.69 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.897 -0.779 . . . . 1.27 108.897 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.618 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 22.1 Cg_endo -62.95 132.65 37.84 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 123.998 3.132 . . . . 0.21 112.346 -176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.597 ' HB ' ' HB2' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -137.37 151.16 26.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.127 0.489 . . . . 0.12 110.41 -178.112 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.801 ' HA ' HG21 ' A' ' 15' ' ' THR . 12.7 p -68.82 161.69 28.0 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 107.081 -1.452 . . . . 0.22 107.081 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' OD1' HD23 ' A' ' 17' ' ' LEU . 5.4 t30 -56.07 -46.09 79.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 119.839 1.199 . . . . 1.52 112.242 -169.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.99 -45.58 31.71 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 111.985 0.365 . . . . 0.21 111.985 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 42' ' ' ARG . 72.0 m -68.37 -45.37 72.97 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.461 0.541 . . . . 0.41 112.461 -177.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.563 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -73.21 -27.52 68.06 Favored Glycine 0 C--O 1.217 -0.914 0 C-N-CA 119.072 -1.537 . . . . 0.46 111.673 177.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB ' ' A' ' -5' ' ' VAL . 8.0 tt -71.71 -43.82 65.23 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.801 -0.815 . . . . 0.54 108.801 174.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HE1' HG23 ' A' ' 40' ' ' VAL . 51.6 t80 -72.76 -48.82 35.24 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.402 -0.817 . . . . 0.44 111.778 -172.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.08 -29.43 67.33 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.441 -0.504 . . . . 0.57 110.536 177.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.563 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 7.9 mptt -72.18 -23.83 61.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 122.294 1.045 . . . . 1.23 109.314 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.79 -37.39 10.29 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 113.385 -1.734 . . . . 1.19 110.212 -175.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' HG22 ' A' ' 40' ' ' VAL . 31.0 m170 -122.17 -0.45 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.559 1.318 . . . . 1.02 114.559 -167.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.54 26.35 15.66 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 112.367 0.506 . . . . 1.87 112.367 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.656 HG23 ' HE1' ' A' ' 34' ' ' TYR . 2.1 m -153.0 163.66 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.444 -0.344 . . . . 0.59 110.131 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.654 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 15.9 m-80 -70.01 162.64 27.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.355 0.409 . . . . 1.73 110.576 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.638 ' HG2' ' CG ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -98.92 100.68 10.28 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.445 -0.576 . . . . 3.32 109.445 -174.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.654 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 46.0 Cg_exo -59.54 117.67 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.045 1.83 . . . . 0.8 111.942 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.69 HD23 ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -125.92 -84.79 0.63 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.256 -0.884 . . . . 1.8 109.663 174.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 42.86 37.86 1.21 Allowed 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.901 -1.045 . . . . 3.21 113.436 -178.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 90.1 mmm 63.78 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.356 0.889 0 CA-C-O 121.415 0.626 . . . . 6.47 110.802 -176.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -128.0 -65.17 0.92 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.127 -0.942 . . . . 10.6 109.168 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -166.95 88.17 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.499 -0.773 . . . . 10.22 110.246 174.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-N 116.439 -0.346 . . . . 7.0 110.378 177.986 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' -15' ' ' HIS . 1.7 mpt? . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 121.079 0.466 . . . . 17.45 110.606 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.62 -28.04 23.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.241 -0.436 . . . . 15.75 111.165 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -82.34 -45.3 15.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.8 0.333 . . . . 15.5 110.345 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . 0.467 ' O ' ' HB3' ' A' ' -18' ' ' MET . 45.3 p-80 -128.73 129.23 45.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.722 -0.473 . . . . 14.5 109.722 176.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -102.27 142.82 32.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.159 -0.473 . . . . 12.71 110.56 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -73.87 113.26 10.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 11.69 109.721 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -90.09 90.82 8.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.21 0.529 . . . . 9.77 110.978 -176.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -95.17 114.53 26.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.643 -0.708 . . . . 9.59 109.602 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 90.73 1.07 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.042 0.448 . . . . 7.05 110.174 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 8.6 t -86.17 62.19 7.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.155 0.502 . . . . 6.01 110.809 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -73.82 -29.11 63.68 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 111.236 -0.746 . . . . 2.88 111.236 175.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.751 ' H ' HD23 ' A' ' -7' ' ' LEU . 1.1 pt? -75.78 60.55 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.9 0.857 . . . . 2.25 110.428 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -86.47 -21.07 27.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.938 -1.028 . . . . 3.44 111.13 -176.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.522 ' HB ' HD12 ' A' ' 33' ' ' LEU . 11.3 p -77.27 120.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.838 -0.619 . . . . 1.67 110.745 -177.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 44.3 tp -117.3 -23.38 7.85 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.015 0.436 . . . . 3.12 110.722 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -83.24 140.55 32.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.99 -0.55 . . . . 2.17 110.93 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.47 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 16.0 mm100 53.1 72.46 0.42 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.805 -0.634 . . . . 2.74 111.56 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -178.91 124.34 0.91 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.377 -0.916 . . . . 1.43 113.188 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -77.4 -153.83 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 123.323 2.682 . . . . 2.08 112.063 174.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -155.27 158.21 38.45 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 5.35 110.134 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' HD1' ' A' ' 18' ' ' TRP . 18.7 ttt180 -158.54 175.75 13.27 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.679 -0.86 . . . . 2.94 108.679 -177.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.29 166.32 28.36 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.964 -0.384 . . . . 1.09 109.964 170.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 51.86 40.16 49.15 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 120.955 -0.64 . . . . 0.54 112.756 -173.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.518 ' O ' HG22 ' A' ' 13' ' ' THR . 0.2 OUTLIER -120.2 178.64 4.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.697 -0.296 . . . . 0.38 111.03 -174.186 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.465 ' H ' HG22 ' A' ' 5' ' ' THR . 0.5 OUTLIER -133.83 151.77 51.66 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.712 0.291 . . . . 0.86 110.852 177.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 9' ' ' ASN . 49.3 t -83.64 124.36 30.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.28 -0.418 . . . . 0.21 111.563 -171.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 24.35 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.943 1.297 . . . . 0.31 113.614 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.494 ' H ' ' C ' ' A' ' 7' ' ' CYS . 43.4 t30 -159.18 -47.72 0.06 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.999 -0.28 . . . . 0.57 111.715 -173.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.4 p -123.24 9.96 9.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 119.027 -1.069 . . . . 0.76 111.879 -174.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 39.71 23.31 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.814 1.783 . . . . 1.9 115.814 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -66.68 153.87 42.08 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.378 -0.971 . . . . 0.33 108.378 166.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 5' ' ' THR . 19.5 p -129.17 2.71 5.2 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.951 0.882 . . . . 0.42 109.595 178.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.71 71.94 3.07 Favored 'General case' 0 N--CA 1.425 -1.699 0 CA-C-N 114.039 -1.437 . . . . 1.26 109.369 177.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.622 HG21 ' HA ' ' A' ' 28' ' ' CYS . 29.5 m -148.71 133.84 18.27 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.552 -0.749 . . . . 0.4 110.252 -174.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.05 -9.29 22.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.191 0.52 . . . . 0.54 110.839 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.612 ' H ' HG22 ' A' ' 15' ' ' THR . 18.0 tp -123.5 79.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.174 0.512 . . . . 0.79 110.817 -173.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.455 ' HD1' ' O ' ' A' ' 2' ' ' ARG . 93.9 m95 -83.34 97.13 8.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.609 -0.723 . . . . 0.18 111.603 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.03 172.88 9.65 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 115.388 -0.824 . . . . 2.03 109.913 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -111.11 147.46 34.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.002 0.43 . . . . 3.9 110.681 -178.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.4 p30 -98.26 -168.53 1.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.518 -0.753 . . . . 0.2 109.427 -178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.13 -28.07 56.48 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.635 0.976 . . . . 0.36 113.635 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -94.71 -6.81 42.35 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 122.611 1.196 . . . . 1.61 107.806 -177.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.91 29.08 32.66 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 113.285 -1.78 . . . . 0.22 110.426 -172.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.516 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -90.58 139.17 26.45 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 114.791 -0.705 . . . . 1.27 109.162 -177.678 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 18.7 Cg_endo -61.46 133.87 48.37 Favored 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 124.031 3.154 . . . . 0.21 113.255 -174.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.19 149.5 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.113 -0.699 . . . . 0.12 109.113 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' HG21 ' A' ' 15' ' ' THR . 8.5 p -71.59 166.19 22.35 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.114 -1.439 . . . . 0.22 107.114 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.21 69.05 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 119.5 1.045 . . . . 1.52 111.361 -172.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.516 ' HB1' ' HD3' ' A' ' 42' ' ' ARG . . . -54.19 -48.37 71.03 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 112.795 0.665 . . . . 0.21 112.795 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.6 m -78.14 -25.46 47.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.442 -0.503 . . . . 0.41 111.571 -175.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.757 ' O ' ' HD3' ' A' ' 36' ' ' LYS . . . -81.75 -31.78 31.87 Favored Glycine 0 C--O 1.221 -0.706 0 C-N-CA 120.042 -1.075 . . . . 0.46 112.151 170.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 8.5 tt -71.36 -45.66 62.32 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.688 -0.856 . . . . 0.54 108.688 178.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 42' ' ' ARG . 34.3 t80 -68.32 -44.0 76.34 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.905 -0.589 . . . . 0.44 110.884 -172.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 89.3 t80 -60.22 -25.66 65.8 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.299 -0.864 . . . . 0.57 111.6 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.757 ' HD3' ' O ' ' A' ' 32' ' ' GLY . 4.2 mptp? -76.71 -36.67 57.06 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.697 0.761 . . . . 1.23 110.13 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.9 mt -73.79 -40.81 63.15 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.451 -1.249 . . . . 1.19 110.25 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 65.3 m170 -121.32 -2.08 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.362 1.245 . . . . 1.02 114.362 -162.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' HIS . 12.0 m120 68.57 14.8 9.1 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.142 0.277 . . . . 1.87 111.502 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.563 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -143.6 156.59 16.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 C-N-CA 120.859 -0.336 . . . . 0.59 110.478 179.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.503 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 1.7 p30 -70.75 160.35 32.84 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 109.01 -0.737 . . . . 1.73 109.01 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.516 ' HD3' ' HB1' ' A' ' 30' ' ' ALA . 48.3 ttt180 -84.11 114.16 52.67 Favored Pre-proline 0 C--N 1.318 -0.79 0 C-N-CA 120.661 -0.416 . . . . 3.32 110.38 -172.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.503 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 89.2 Cg_exo -53.84 116.99 3.39 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.731 1.621 . . . . 0.8 110.503 171.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 44' ' ' LEU . 2.6 tp -159.64 -142.78 0.09 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.063 -0.971 . . . . 1.8 108.39 -168.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.4 m 79.66 -50.49 0.39 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.954 0.784 . . . . 3.21 112.284 168.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.427 ' CG ' ' HB2' ' A' ' 49' ' ' GLU . 12.5 tpt -162.64 165.84 25.29 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.254 -1.017 . . . . 6.47 108.254 -178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.3 75.25 1.0 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.811 -0.44 . . . . 10.6 109.811 176.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 59.78 82.73 0.15 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.861 -1.063 . . . . 10.22 111.557 -175.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB2' ' CG ' ' A' ' 46' ' ' MET . 38.3 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.68 -0.676 . . . . 7.0 110.089 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -18' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.735 0.303 . . . . 17.45 111.068 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -17' ' ' ALA . . . . . . . . . . . . . . . -86.98 151.99 22.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.817 0.341 . . . . 15.75 111.312 -176.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -16' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -136.89 123.13 20.53 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.896 -0.593 . . . . 15.5 109.761 175.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -15' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -84.66 67.89 10.18 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.677 0.751 . . . . 14.5 110.722 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -14' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -83.05 -35.08 26.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.469 -0.787 . . . . 12.71 110.089 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -13' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -135.92 145.04 45.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.913 -0.585 . . . . 11.69 109.929 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -12' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -157.38 -23.11 0.09 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.636 0.255 . . . . 9.77 110.425 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -11' ' ' HIS . . . . . . . . . . . . . 31.5 m-70 72.89 -68.44 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.646 0.778 . . . . 9.59 111.389 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -10' ' ' SER . . . . . . . . . . . . . 7.6 m -81.25 116.4 21.11 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.972 -0.381 . . . . 7.05 109.972 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -9' ' ' SER . . . . . . . . . . . . . 23.1 t -112.92 -50.33 2.89 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.873 0.368 . . . . 6.01 110.624 -178.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -8' ' ' GLY . . . . . . . . . . . . . . . -81.87 77.91 2.01 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 2.88 112.043 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -7' ' ' LEU . . . . . 0.495 ' C ' HD22 ' A' ' 17' ' ' LEU . 84.0 mt -92.73 77.08 4.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.796 0.331 . . . . 2.25 110.529 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -158.48 142.93 15.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 3.44 111.094 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' VAL . . . . . 0.567 HG23 ' HG ' ' A' ' 33' ' ' LEU . 5.0 p -126.66 1.76 4.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.243 0.544 . . . . 1.67 109.656 173.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 62.9 mt 77.55 -65.38 0.27 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 114.905 -1.043 . . . . 3.12 111.859 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -88.91 177.95 6.55 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.698 0.259 . . . . 2.17 111.698 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLN . . . . . 0.566 ' HB3' HH12 ' A' ' 19' ' ' ARG . 34.4 tp60 62.91 97.3 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.889 -0.596 . . . . 2.74 110.203 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . -58.67 115.92 7.87 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.287 -0.415 . . . . 1.43 113.743 -174.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -94.25 146.01 1.85 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.513 2.809 . . . . 2.08 112.884 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -177.22 128.72 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.363 -0.38 . . . . 5.35 110.691 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' CB ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER 174.74 -32.24 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 O-C-N 123.637 0.586 . . . . 2.94 111.247 174.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.34 -83.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.398 0.888 . . . . 1.09 113.398 173.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -108.49 65.46 0.25 Allowed Glycine 0 CA--C 1.522 0.476 0 C-N-CA 121.435 -0.412 . . . . 0.54 112.437 -174.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.717 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.1 m -121.63 -172.49 2.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.432 0.616 . . . . 0.38 110.756 -175.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.717 ' H ' HG22 ' A' ' 5' ' ' THR . 1.3 p -122.39 150.23 42.72 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.459 0.304 . . . . 0.86 110.976 174.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.517 ' C ' ' H ' ' A' ' 9' ' ' ASN . 38.0 t -81.2 126.06 31.04 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.165 -0.471 . . . . 0.21 111.83 -172.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.96 24.97 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.939 1.296 . . . . 0.31 113.693 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.517 ' H ' ' C ' ' A' ' 7' ' ' CYS . 39.5 t30 -156.72 -48.42 0.07 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.546 -0.297 . . . . 0.57 110.995 -176.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 14.2 p -120.5 6.25 10.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 119.301 -0.96 . . . . 0.76 111.873 -172.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 43.14 20.83 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.881 1.808 . . . . 1.9 115.881 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.5 t -65.67 151.27 46.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.602 -0.518 . . . . 0.33 109.602 167.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.63 HG22 ' O ' ' A' ' 5' ' ' THR . 23.5 p -129.54 8.17 5.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.248 -0.887 . . . . 0.42 110.463 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' THR . 11.9 t -99.29 48.57 0.95 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.559 1.171 . . . . 1.26 109.143 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.649 HG22 ' H ' ' A' ' 17' ' ' LEU . 2.7 m -129.53 138.69 51.48 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.522 -1.217 . . . . 0.4 111.164 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.4 ' H ' HD13 ' A' ' -7' ' ' LEU . 1.8 m -103.84 3.86 34.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.826 -0.625 . . . . 0.54 110.489 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.649 ' H ' HG22 ' A' ' 15' ' ' THR . 13.9 tp -130.47 83.77 2.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 120.717 -0.393 . . . . 0.79 110.688 -171.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.482 ' CB ' ' HB2' ' A' ' 2' ' ' ARG . 88.8 m95 -93.0 95.72 9.64 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-O 121.825 0.821 . . . . 0.18 111.484 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.566 HH12 ' HB3' ' A' ' -2' ' ' GLN . 0.0 OUTLIER -87.78 171.51 10.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.48 -1.236 . . . . 2.03 109.427 175.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.533 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . 5.6 mmt-85 -103.44 147.26 27.36 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.941 0.401 . . . . 3.9 111.341 174.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.31 -168.78 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.927 -0.768 . . . . 0.2 108.927 171.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.37 -22.73 44.57 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.429 0.9 . . . . 0.36 113.429 -174.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -91.17 -10.04 43.26 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.197 -1.038 . . . . 1.61 108.197 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.533 ' HA2' ' HB3' ' A' ' 20' ' ' ARG . . . 83.95 24.83 47.46 Favored Glycine 0 N--CA 1.425 -2.048 0 N-CA-C 109.413 -1.475 . . . . 0.22 109.413 -168.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.557 ' OD1' ' HD2' ' A' ' 26' ' ' PRO . 0.3 OUTLIER -91.88 141.81 25.85 Favored Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 109.548 -0.538 . . . . 1.27 109.548 -174.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' OD1' ' A' ' 25' ' ' ASP . 12.0 Cg_endo -61.28 130.71 33.2 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 123.926 3.084 . . . . 0.21 113.032 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 0.6 OUTLIER -140.97 149.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 109.529 -0.545 . . . . 0.12 109.529 178.626 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.49 ' HB2' HG21 ' A' ' 15' ' ' THR . 6.1 p -71.33 171.04 11.88 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 108.634 -0.876 . . . . 0.22 108.634 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -49.3 -55.46 12.68 Favored 'General case' 0 C--O 1.214 -0.811 0 CA-C-N 118.877 0.762 . . . . 1.52 112.085 -175.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.35 -52.37 64.84 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.771 0.656 . . . . 0.21 112.771 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' HD11 ' A' ' 44' ' ' LEU . 72.1 m -65.01 -34.16 77.77 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.671 0.248 . . . . 0.41 111.671 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.732 ' O ' ' HD2' ' A' ' 36' ' ' LYS . . . -77.32 -46.15 10.46 Favored Glycine 0 N--CA 1.463 0.493 0 C-N-CA 120.101 -1.047 . . . . 0.46 111.773 172.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.68 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 6.7 tt -57.71 -43.85 85.52 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.123 -0.695 . . . . 0.54 109.123 -176.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HE1' HG23 ' A' ' 40' ' ' VAL . 55.6 t80 -72.33 -45.8 58.37 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.863 -0.608 . . . . 0.44 111.092 -172.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -58.82 -28.46 66.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.857 -0.61 . . . . 0.57 110.373 176.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' ' O ' ' A' ' 32' ' ' GLY . 0.9 OUTLIER -68.41 -36.94 79.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 122.008 0.908 . . . . 1.23 109.505 -178.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 5.5 mt -78.08 -43.29 29.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.147 -1.388 . . . . 1.19 110.302 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' O ' HG22 ' A' ' 40' ' ' VAL . 66.3 m170 -121.73 0.39 9.81 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.409 1.262 . . . . 1.02 114.409 -161.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.89 28.17 17.18 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 112.063 0.394 . . . . 1.87 112.063 176.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG23 ' HE1' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -152.68 162.23 2.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.43 -0.35 . . . . 0.59 110.437 -178.338 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.547 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 13.4 m-80 -66.77 158.65 29.8 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.31 0.381 . . . . 1.73 110.424 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.714 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.4 tmt_? -90.63 110.43 41.28 Favored Pre-proline 0 N--CA 1.45 -0.471 0 N-CA-C 109.512 -0.551 . . . . 3.32 109.512 -172.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.547 ' HD3' ' O ' ' A' ' 41' ' ' ASN . 83.9 Cg_exo -54.02 120.52 8.06 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.301 2.0 . . . . 0.8 111.432 172.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 42' ' ' ARG . 10.7 mt -123.65 -140.97 0.31 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.77 -0.65 . . . . 1.8 109.514 -170.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 48' ' ' LYS . 6.5 m 69.61 -86.82 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 123.552 0.533 . . . . 3.21 110.961 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 45.2 tpp 53.62 84.0 0.06 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.419 0.687 . . . . 6.47 110.879 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 47' ' ' LYS . 34.9 tptt 66.64 37.23 4.45 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.575 -0.739 . . . . 10.6 109.666 -177.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.441 ' H ' HG22 ' A' ' 45' ' ' THR . 56.5 tttp 48.93 74.1 0.2 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.339 -1.3 . . . . 10.22 112.737 -177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.465 -0.778 . . . . 7.0 109.992 173.444 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_